Ojima:KOX00579n

General Index

All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

Help

150px
Tyr

IDs and Links
MassBank	Tyr
CAS	60-18-4
Keio ID	T002-

Top 10 Similar Molecules of Tyr

Ranking	About scoring
P079+ Score:11.26 H050+ Score:6.63 I050+ Score:6.23 I019+ Score:6.23 C063+ Score:6.23 S041+ Score:5.02 N063+ Score:5.02 K005+ Score:5.02 C047+ Score:5.02 A114+ Score:5.02	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 C9H10NO3:   H050+   Pages Related to Peak C9H7O3:   C063+  I050+   Pages Related to Peak C8H6NO2:   I019+  P079+   Pages Related to Peak C8H7O:   D046+  E033+  L007+  T002+  A137+  A226+  D185+  E013+  P070+  Q001+  S058+  T032+  T041+  T044+  V021+   Pages Related to Peak C6H5O:   D128+  H027+  T003+  A114+  C047+  K005+  N063+  P079+  S041+

Annotations

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。

KOX00579n	180 C9H10NO3	163 C9H7O3	148 C8H6NO2	119 C8H7O	93 C6H5O	72 C2H2NO2	60 C2H4O2	59 C2H3O2
180 C9H10NO3
163 C9H7O3	H3N
148 C8H6NO2	CH4O
119 C8H7O	CH3NO2	CO2
93 C6H5O	C3H5NO2	C3H2O2	C2HNO	C2H2
72 C2H2NO2	C7H8O		C6H4
60 C2H4O2	C7H6NO	C7H3O	C6H2N
59 C2H3O2	C7H7NO	C7H4O	C6H3N				H

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

Next Page>(pos/neg)   Last Page>>(pos/neg)