Ojima:KOX00151n

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Ion Frequency

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Neutral Loss

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2-Carboxybenzaldehyde

IDs and Links
MassBank	2-Carboxybenzaldehyde
CAS	119-67-5
Keio ID	C038-

Top 10 Similar Molecules of 2-Carboxybenzaldehyde

Ranking	About scoring
L016+ Score:6.63 P028+ Score:6.23 E015+ Score:6.23 B026+ Score:5.94 B009+ Score:5.94 X004+ Score:5.94	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。

Links

Page list for each fragment
Pages Related to Peak C8H5O3:   L016+   Pages Related to Peak C7H5O:   X004+  B009+  B026+   Pages Related to Peak C3H5O3:   E015+  P028+

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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。

KOX00151n	149 C8H5O3	105 C7H5O	89 C3H5O3	69 C3HO2	45 CHO2
149 C8H5O3
105 C7H5O	CO2
89 C3H5O3	C5
69 C3HO2	C5H4O		H4O
45 CHO2	C7H4O		C2H4O	C2

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