MassBank:KOX00120p

General Index

All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

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6-Benzylaminopurine

IDs and Links
MassBank	6-Benzylaminopurine
CAS	1214-39-7
Keio ID	B015+

Top 10 Similar Molecules of 6-Benzylaminopurine

Ranking	About scoring
KOX00880p Score:8.84 KOX00879p Score:8.84 KOX00878p Score:8.84 KOX00872p Score:8.84 KOX00870p Score:8.84 KOX00859p Score:8.84 KOX00834p Score:8.84 KOX00809p Score:8.84 KOX00807p Score:8.84 KOX00797p Score:8.84	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
C12H12N5 (226)	C6H6N5 (148)	c
C12H12N5 (226)	C7H7 (91)	a
C12H12N5 (226)	C6H5 (77)	b
C12H12N5 (226)	C5H5 (65)	d

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。

KOX00120p	226 C12H12N5	148 C6H6N5	91 C7H7	77 C6H5	65 C5H5
226 C12H12N5
148 C6H6N5	C6H6
91 C7H7	C5H5N5
77 C6H5	C6H7N5	HN5	CH2
65 C5H5	C7H7N5	CHN5	C2H2	C

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