MassBank:KOX00790p

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All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

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N-Methyl-N-propagylbenzylamine

IDs and Links
MassBank	N-Methyl-N-propagylbenzylamine
CAS	555-57-7
Keio ID	M071+

Top 10 Similar Molecules of N-Methyl-N-propagylbenzylamine

Ranking	About scoring
KOX00879p Score:9.22 KOX00872p Score:9.22 KOX00870p Score:9.22 KOX00859p Score:9.22 KOX00809p Score:9.22 KOX00807p Score:9.22 KOX00797p Score:9.22 KOX00725p Score:9.22 KOX00713p Score:9.22 KOX00694p Score:9.22	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
C11H14N (160)	C7H7 (91)	a
C11H14N (160)	C5H5 (65)	b
C11H14N (160)	C4H3 (51)	c

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。

KOX00790p	160 C11H14N	91 C7H7	65 C5H5	51 C4H3
160 C11H14N
91 C7H7	C4H7N
65 C5H5	C6H9N	C2H2
51 C4H3	C7H11N	C3H4	CH2

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