Ojima:KOX00036p

General Index

All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

Help

3-Amino-1,2,4-triazole

IDs and Links
MassBank	3-Amino-1,2,4-triazole
CAS	61-82-5
Keio ID	A045+

Top 10 Similar Molecules of 3-Amino-1,2,4-triazole

Ranking	About scoring
A045+ Score:17.89 P049+ Score:6.63 C094+ Score:6.23 M032+ Score:5.94 B010+ Score:5.94 A166+ Score:5.72 M110+ Score:5.72 C208+ Score:5.72	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 C2H5N4:   A045+  B010+  M032+   Pages Related to Peak CH4N3:   A045+  C094+   Pages Related to Peak C2H5N2:   A045+  C208+  M110+  A166+   Pages Related to Peak CH3N2:   P049+

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。

KOX00036p	85 C2H5N4	58 CH4N3	57 C2H5N2	43 CH3N2
85 C2H5N4
58 CH4N3	CHN
57 C2H5N2	N2
43 CH3N2	CH2N2	HN	CH2

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

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