Ojima:KNA00626n

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All Molecules KOX PR PBX COX

Ion Frequency

Prec.-Product

Neutral Loss

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MassBank	[1]
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Top 10 Similar Molecules of

Ranking	About scoring
L016+ Score:6.64	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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Pages Related to Peak C6H10NO3S:   L016+

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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。

KNA00626n	383 C14H19N6O5S	282 C10H12N5O3S	248 C9H14NO5S	188 C7H10NO3S	176 C6H10NO3S	134 C5H4N5
383 C14H19N6O5S
282 C10H12N5O3S	C4H7NO2
248 C9H14NO5S	C5H5N5
188 C7H10NO3S	C7H9N5O2	C3H2N4	C2H4O2
176 C6H10NO3S	C8H9N5O2	C4H2N4	C3H4O2	C
134 C5H4N5	C9H15NO5S	C5H8O3S

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