MassBank:KOX00599p

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All Molecules KOX PR PBX COX

Ion Frequency

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Neutral Loss

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3,3,5-Triiodothyronine

IDs and Links
MassBank	3,3,5-Triiodothyronine
CAS	6893-02-3
Keio ID	T040+

Top 10 Similar Molecules of 3,3,5-Triiodothyronine

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。

Illegal ion order (check mass!): C15H13NO4I3 < C15H10I3O4

KOX00599p	271 C15H13NO4I3	635 C15H10I3O4	606 C14H11I3NO2	508 C15H10I2O4	479 C14H11I2NO2	451 C13H9I2O2	381 C15H10IO4	352 C14H11INO2	254 C15H10O4	225 C14H11NO2	198 C13H10O2
271 C15H13NO4I3
635 C15H10I3O4
606 C14H11I3NO2
508 C15H10I2O4		I
479 C14H11I2NO2			I
451 C13H9I2O2		C2HIO2	CH2IN	C2HO2	CH2N
381 C15H10IO4		I2		I
352 C14H11INO2			I2		I
254 C15H10O4	H3N	I3		I2			I
225 C14H11NO2	CH2O2		I3		I2			I
198 C13H10O2	C2H3NO2	C2I3O2	CHI3N	C2I2O2	CHI2N		C2IO2	CHIN	C2O2	CHN

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