MassBank:KOX00889p

General Index

All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

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Tilt (TM)

IDs and Links
MassBank	Tilt (TM)
CAS	60207-90-1
Keio ID	T108+

Top 10 Similar Molecules of Tilt (TM)

Ranking	About scoring
KOX00903p Score:4.15 KOX00858p Score:4.15 KOX00857p Score:4.15 KOX00822p Score:4.15 KOX00773p Score:4.15 KOX00762p Score:4.15 KOX00719p Score:4.15 KOX00685p Score:4.15 KOX00682p Score:4.15 KOX00645p Score:4.15	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。

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Annotations

Precursor	Product	Comments
C15H18Cl2N3O2 (342)	C12H13Cl2O2 (259)	a
C15H18Cl2N3O2 (342)	C5H9 (69)	f

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。

KOX00889p	342 C15H18Cl2N3O2	259 C12H13Cl2O2	173 C7H3Cl2O	159 C7H5Cl2	123 C7H4Cl	69 C5H9
342 C15H18Cl2N3O2
259 C12H13Cl2O2	C3H5N3
173 C7H3Cl2O	C8H15N3O	C5H10O
159 C7H5Cl2	C8H13N3O2	C5H8O2
123 C7H4Cl	C8H14ClN3O2	C5H9ClO2		HCl
69 C5H9	C10H9Cl2N3O2	C7H4Cl2O2

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