Ojima:KOX00195p

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All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

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Diazoxide

IDs and Links
MassBank	Diazoxide
CAS	364-98-7
Keio ID	D051+

Top 10 Similar Molecules of Diazoxide

Ranking	About scoring
D051+ Score:22.56 N044+ Score:5.69 D030+ Score:5.69 T060+ Score:5.69 T031+ Score:5.69 T008+ Score:5.69 S058+ Score:5.69 S041+ Score:5.69 Q008+ Score:5.69 Q001+ Score:5.69	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 C8H8ClN2O2S:   D051+   Pages Related to Peak C6H5ClNO2S:   D051+   Pages Related to Peak C6H5ClN:   D051+   Pages Related to Peak C6H5:   A010+  A043+  A050+  A053+  A067+  A110+  A130+  B007+  B015+  B018+  B020+  D046+  D051+  D166+  E012+  E033+  H029+  H139+  I015+  I019+  I022+  I025+  I030+  I038+  M037+  M040+  M053+  M078+  M127+  N018+  P002+  P014+  P033+  P053+  P059+  P113+  S013+  T002+  T003+  T054+  T112+  X004+  A035+  A036+  A054+  A061+  A064+  A080+  B004+  B009+  B011+  B013+  B026+  C172+  D032+  D039+  D061+  D087+  D178+  D180+  D185+  E013+  F016+  G041+  H045+  I063+  I067+  K004+  K005+  L027+  L031+  M039+  M066+  M082+  M101+  M142+  M150+  M167+  M169+  M172+  N016+  N028+  N067+  O007+  P036+  P047+  P054+  P057+  P061+  P079+  Q001+  Q008+  S040+  S041+  S058+  T008+  T024+  T028+  T030+  T031+  T032+  T060+  T126+  D030+  A155+  N044+   Pages Related to Peak C4H3:   A010+  A043+  A050+  A130+  B007+  D046+  D166+  E012+  E033+  H015+  H029+  H139+  I019+  I022+  I030+  I038+  M127+  N004+  N018+  P002+  P033+  P053+  P059+  T002+  X004+  A036+  A054+  A061+  A224+  B004+  B009+  B011+  B013+  C089+  C172+  D032+  D087+  D178+  D180+  E013+  F013+  G041+  H021+  H112+  I017+  I051+  I067+  M063+  M066+  M071+  M101+  M167+  M172+  N001+  N016+  N028+  P041+  P045+  P047+  P056+  P057+  P079+  P099+  Q001+  Q008+  S041+  S058+  T008+  T031+  T060+  D030+  N044+

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。

KOX00195p	231 C8H8ClN2O2S	190 C6H5ClNO2S	126 C6H5ClN	77 C6H5	51 C4H3
231 C8H8ClN2O2S
190 C6H5ClNO2S	C2H3N
126 C6H5ClN	C2H3NO2S	O2S
77 C6H5	C2H3ClN2O2S	ClNO2S	ClN
51 C4H3	C4H5ClN2O2S	C2H2ClNO2S	C2H2ClN	C2H2

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