Ojima:KOX00191n

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2,6-Dichloro-4-nitroaniline

IDs and Links
MassBank	2,6-Dichloro-4-nitroaniline
CAS	99-30-9
Keio ID	D048-

Top 10 Similar Molecules of 2,6-Dichloro-4-nitroaniline

Ranking	About scoring
	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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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。

./lua: /tmp/mw_ex_lua_hXVU2D:33: attempt to compare number with nil

KOX00191n	206 C6H4Cl2N2O2	175 C6H3Cl2NO	169 C6H2ClN2O2	159 C6H3Cl2N	158 C6H2Cl2N	139 C6H2ClNO	123 C6H2ClN	12 Cl
206 C6H4Cl2N2O2
175 C6H3Cl2NO	HNO
169 C6H2ClN2O2	H2Cl
159 C6H3Cl2N	HNO2	O
158 C6H2Cl2N	H2NO2	HO		H
139 C6H2ClNO	H2ClNO	HCl	NO
123 C6H2ClN	H2ClNO2	HClO	NO2	HCl	Cl	O
12 Cl (pos/neg)<<First Page   (pos/neg)<Previous Page Next Page>(pos/neg)   Last Page>>(pos/neg)