Latest revision as of 13:43, 4 November 2009

All Molecules
KOX PR PBX COX

Methoxamine

[edit] Top 10 Similar Molecules of Methoxamine

Ranking	About scoring
KOX00236p Score:26.55 KOX00880p Score:26.31 KOX00723p Score:23.56 KOX00580p Score:19.67 KOX00807p Score:19.57 KOX00866p Score:19.51 KOX00377p Score:18.9 KOX00895p Score:18.6 KOX00879p Score:17.95 KOX00797p Score:17.95	The similarity score between two molecules is defined as the sum of Shannon entropy of ionic formulas shared by the molecules: $\textstyle - \sum_{p\in shared} \log(\mbox{frequency}(p))$ 代謝物間の類似度スコアは、それらのスペクトルで共有される（アノテートされた）イオン式のシャノン情報量の総和です。

[edit] Links

Page list for each fragment
Pages Related to Peak C10H11O3: KOX00880p Pages Related to Peak C10H12NO: KOX00053p KOX00723p KOX00834p Pages Related to Peak C9H9NO: KOX00723p Pages Related to Peak C8H9O2: KOX00189p KOX00722p KOX00725p KOX00880p Pages Related to Peak C7H7O2: KOX00236p KOX00536p KOX00580p KOX00814p Pages Related to Peak C8H8N: KOX00053p KOX00157p KOX00236p KOX00238p KOX00325p KOX00359p KOX00377p KOX00385p KOX00424p KOX00433p KOX00485p KOX00514p KOX00526p KOX00580p KOX00582p KOX00604p KOX00647p KOX00648p KOX00657p KOX00658p KOX00674p KOX00687p KOX00703p KOX00718p KOX00723p KOX00766p KOX00797p KOX00798p KOX00809p KOX00811p KOX00836p KOX00859p KOX00866p KOX00870p KOX00878p KOX00879p KOX00880p KOX00912p Pages Related to Peak C9H7: KOX00122p KOX00325p KOX00328p KOX00377p KOX00379p KOX00424p KOX00433p KOX00471p KOX00582p KOX00604p KOX00674p KOX00767p KOX00797p KOX00798p KOX00807p KOX00866p KOX00879p Pages Related to Peak C8H11: KOX00645p KOX00882p KOX00895p Pages Related to Peak C7H7O: KOX00160p KOX00189p KOX00199p KOX00236p KOX00385p KOX00514p KOX00580p KOX00658p KOX00722p KOX00723p KOX00807p KOX00814p KOX00836p KOX00870p KOX00880p KOX00881p KOX00882p KOX00892p KOX00895p Pages Related to Peak C8H9: KOX00558p KOX00703p KOX00719p KOX00720p KOX00731p KOX00795p KOX00807p KOX00828p KOX00866p KOX00882p KOX00895p Pages Related to Peak C7H6N: KOX00236p KOX00359p KOX00379p KOX00381p KOX00422p KOX00491p KOX00510p KOX00604p KOX00628p KOX00637p KOX00647p KOX00657p KOX00670p KOX00713p KOX00766p KOX00797p KOX00800p KOX00804p KOX00809p KOX00811p KOX00817p KOX00832p KOX00840p KOX00860p KOX00866p KOX00872p KOX00877p KOX00878p KOX00879p KOX00912p Pages Related to Peak C7H7: KOX00053p KOX00120p KOX00122p KOX00126p KOX00154p KOX00189p KOX00236p KOX00238p KOX00325p KOX00359p KOX00377p KOX00424p KOX00433p KOX00456p KOX00471p KOX00485p KOX00514p KOX00558p KOX00580p KOX00582p KOX00604p KOX00635p KOX00645p KOX00647p KOX00649p KOX00658p KOX00667p KOX00674p KOX00694p KOX00703p KOX00713p KOX00718p KOX00722p KOX00725p KOX00731p KOX00738p KOX00747p KOX00766p KOX00770p KOX00790p KOX00797p KOX00798p KOX00807p KOX00809p KOX00834p KOX00836p KOX00857p KOX00859p KOX00870p KOX00872p KOX00875p KOX00878p KOX00879p KOX00880p KOX00883p KOX00900p Pages Related to Peak C6H5: KOX00006p KOX00034p KOX00041p KOX00043p KOX00053p KOX00064p KOX00073p KOX00118p KOX00120p KOX00122p KOX00126p KOX00189p KOX00195p KOX00221p KOX00231p KOX00236p KOX00328p KOX00359p KOX00368p KOX00371p KOX00374p KOX00377p KOX00379p KOX00381p KOX00422p KOX00424p KOX00433p KOX00445p KOX00456p KOX00471p KOX00485p KOX00491p KOX00501p KOX00510p KOX00514p KOX00536p KOX00558p KOX00580p KOX00582p KOX00604p KOX00616p KOX00628p KOX00637p KOX00638p KOX00643p KOX00645p KOX00646p KOX00649p KOX00670p KOX00671p KOX00673p KOX00674p KOX00676p KOX00694p KOX00697p KOX00703p KOX00705p KOX00713p KOX00719p KOX00720p KOX00722p KOX00725p KOX00731p KOX00738p KOX00747p KOX00762p KOX00763p KOX00766p KOX00767p KOX00769p KOX00770p KOX00784p KOX00789p KOX00795p KOX00797p KOX00804p KOX00805p KOX00807p KOX00809p KOX00811p KOX00814p KOX00817p KOX00819p KOX00824p KOX00828p KOX00830p KOX00832p KOX00834p KOX00840p KOX00859p KOX00860p KOX00865p KOX00866p KOX00870p KOX00872p KOX00875p KOX00877p KOX00878p KOX00879p KOX00880p KOX00886p KOX00892p KOX00900p KOX00903p KOX00912p Pages Related to Peak C5H7: KOX00016p KOX00041p KOX00043p KOX00067p KOX00069p KOX00095p KOX00126p KOX00174p KOX00197p KOX00290p KOX00292p KOX00343p KOX00347p KOX00393p KOX00420p KOX00469p KOX00491p KOX00499p KOX00508p KOX00512p KOX00633p KOX00645p KOX00647p KOX00649p KOX00661p KOX00685p KOX00687p KOX00691p KOX00709p KOX00710p KOX00731p KOX00736p KOX00747p KOX00762p KOX00767p KOX00769p KOX00770p KOX00782p KOX00784p KOX00819p KOX00822p KOX00830p KOX00865p KOX00875p KOX00887p KOX00895p Pages Related to Peak C3H6N: KOX00022p KOX00041p KOX00051p KOX00056p KOX00062p KOX00064p KOX00069p KOX00079p KOX00095p KOX00136p KOX00167p KOX00225p KOX00229p KOX00236p KOX00254p KOX00259p KOX00268p KOX00270p KOX00276p KOX00281p KOX00308p KOX00313p KOX00343p KOX00347p KOX00364p KOX00393p KOX00406p KOX00420p KOX00454p KOX00476p KOX00508p KOX00514p KOX00529p KOX00586p KOX00590p KOX00593p KOX00623p KOX00636p KOX00640p KOX00648p KOX00662p KOX00680p KOX00681p KOX00684p KOX00687p KOX00688p KOX00698p KOX00700p KOX00702p KOX00713p KOX00723p KOX00729p KOX00733p KOX00743p KOX00749p KOX00761p KOX00762p KOX00769p KOX00778p KOX00779p KOX00793p KOX00802p KOX00803p KOX00822p KOX00827p KOX00838p KOX00856p KOX00874p KOX00875p KOX00876p KOX00887p KOX00888p KOX00890p KOX00900p KOX00905p KOX00911p Pages Related to Peak C3H3O: KOX00064p KOX00083p KOX00140p KOX00176p KOX00223p KOX00266p KOX00290p KOX00377p KOX00476p KOX00529p KOX00642p

[edit] Annotations

Precursor	Product	Comments
C11H18NO3 (212)	C11H16NO2 (194)	a
C11H18NO3 (212)	C8H10O2 (138)	b,rad.
C11H18NO3 (212)	C8H9O2 (137)	b
C11H16NO2 (194)	C10H12NO (162)	IT
C11H16NO2 (194)	C8H9O2 (137)	IT

[edit] Precursor-Product Relationship

About the PP Table (行列表示について)

The matrix is viewed columnwise. The topmost precursor ion in bold face produces the product ions beneath it.

Each formula in matrix cells corresponds to the neutral loss. Blackout cells indicate products that cannot be derived, and orange cells indicate a structurally plausible link produced by cleaving a single chemical bond (in cases of ring-opening, two bonds).

行列は列方向に見ます。最上段太字の前駆イオン(precursor ion)が直下の生成イオン群(product ions)になると解釈します。

行列要素に書かれている組成式はニュートラルロスです。黒は前駆イオンから生成しえない関係、オレンジは分子構造における共有結合1本の切断（開環の場合は2本）で生じる関係を意味します。

KOX00808p	212 C11H18NO3	194 C11H16NO2	179 C10H11O3	162 C10H12NO	147 C9H9NO	138 C8H10O2	137 C8H9O2	123 C7H7O2	118 C8H8N	115 C9H7	107 C8H11	107 C7H7O	105 C8H9	104 C7H6N	91 C7H7	77 C6H5	67 C5H7	56 C3H6N	55 C3H3O
212 C11H18NO3
194 C11H16NO2	H2O
179 C10H11O3	CH7N
162 C10H12NO	CH6O2	CH4O
147 C9H9NO	C2H9O2	C2H7O		CH3
138 C8H10O2	C3H8NO	C3H6N	C2HO
137 C8H9O2	C3H9NO	C3H7N	C2H2O			H
123 C7H7O2	C4H11NO	C4H9N	C3H4O			CH3	CH2
118 C8H8N	C3H10O3	C3H8O2		C2H4O	CHO
115 C9H7	C2H11NO3	C2H9NO2	CH4O3	CH5NO	H2NO
107 C8H11	C3H7NO3	C3H5NO2	C2O3	C2HNO
107 C7H7O	C4H11NO2	C4H9NO	C3H4O2	C3H5N	C2H2N	CH3O	CH2O	O
105 C8H9	C3H9NO3	C3H7NO2	C2H2O3	C2H3NO	CNO	HO2	O2				H2
104 C7H6N	C4H12O3	C4H10O2		C3H6O	C2H3O				CH2
91 C7H7	C4H11NO3	C4H9NO2	C3H4O3	C3H5NO	C2H2NO	CH3O2	CH2O2	O2	CHN	C2	CH4	O	CH2
77 C6H5	C5H13NO3	C5H11NO2	C4H6O3	C4H7NO	C3H4NO	C2H5O2	C2H4O2	CH2O2	C2H3N	C3H2	C2H6	CH2O	C2H4	CHN	CH2
67 C5H7	C6H11NO3	C6H9NO2	C5H4O3	C5H5NO	C4H2NO	C3H3O2	C3H2O2	C2O2	C3HN	C4	C3H4	C2O	C3H2		C2
56 C3H6N	C8H12O3	C8H10O2		C7H6O	C6H3O				C5H2					C4
55 C3H3O	C8H15NO2	C8H13NO	C7H8O2	C7H9N	C6H6N	C5H7O	C5H6O	C4H4O				C4H4

(pos/neg)<<First Page (pos/neg)<Previous Page

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@@ Line 2: / Line 2: @@
 &&C11H18NO3&&C11H16NO2&&C10H11O3&&C10H12NO&&C9H9NO&&C8H10O2&&C8H9O2&&C7H7O2&&C8H8N&&C9H7&&C8H11&&C7H7O&&C8H9&&C7H6N&&C7H7&&C6H5&&C5H7&&C3H6N&&C3H3O&&
-&&C11H18NO3: C11H16NO2 C8H10O2 C8H9O2
+&&C11H18NO3: C11H16NO2
-&&C11H16NO2: C10H12NO C8H10O2 C8H9O2 C3H6N
+a
-&&C10H11O3: C7H7O2 C3H3O
+&&C11H18NO3: C10H11O3** C10H12NO**
-&&C10H12NO: C3H6N
+&&C11H18NO3: C8H10O2
-&&C8H10O2: C7H7O2
+b,rad.
-&&C8H8N: C6H5
+&&C11H18NO3: C8H9O2
-&&C9H7: C6H5
+b
-&&C8H11: C6H5
+&&C11H18NO3: C7H7O2** C8H8N** C9H7** C8H11** C8H9** C6H5** C3H6N** C3H3O**
-&&C8H9: C6H5
+&&C11H16NO2: C10H12NO
+IT
+&&C11H16NO2: C8H10O2
+&&C11H16NO2: C8H9O2
+IT
+&&C11H16NO2: C7H7O2** C8H8N** C9H7** C8H11** C8H9** C6H5** C3H6N C3H3O*
+&&C10H11O3: C8H10O2* C8H9O2* C7H7O2 C9H7** C8H11** C8H9** C6H5** C3H3O
+&&C10H12NO: C8H8N** C9H7** C8H11** C8H9** C6H5** C3H6N C3H3O*
+&&C8H10O2: C8H9O2* C7H7O2 C8H9* C6H5** C3H3O*
+&&C8H9O2: C7H7O2* C8H9* C6H5** C3H3O*
+&&C7H7O2: C7H7O* C6H5** C3H3O*
+&&C8H8N: C7H6N* C6H5 C3H6N*
+&&C9H7: C7H7* C6H5 C5H7*
+&&C8H11: C8H9* C7H7* C6H5
+&&C7H7O: C7H7*
+&&C8H9: C7H7* C6H5
+&&C7H6N: C3H6N*
+&&C7H7: C6H5* C5H7*
 }}

IDs and Links
MassBank	Methoxamine
CAS	390-28-3
Keio ID	M169+

MassBank:KOX00808p

Latest revision as of 13:43, 4 November 2009

Contents

[edit] Top 10 Similar Molecules of Methoxamine

[edit] Links

[edit] Annotations

[edit] Precursor-Product Relationship

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