Top 10 Similar Molecules of Diethanolamine

[show] Ranking	About scoring
T022+ Score:15.28 D033+ Score:15.28 A224+ Score:11.48 E023+ Score:11.25 S014+ Score:10.74 A032+ Score:9.34 T021+ Score:8.83 C044+ Score:6.23 T051+ Score:5.72 S011+ 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。

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[show] Page list for each fragment
Pages Related to Peak C4H12NO2: A224+ D033+ T022+ Pages Related to Peak C4H10NO: A032+ A224+ B090+ D033+ T022+ Pages Related to Peak C4H8N: A032+ A039+ A110+ C013+ G037+ G117+ I008+ L007+ M067+ O003+ O009+ P003+ P055+ Z003+ A036+ A069+ A103+ A112+ B026+ B040+ D033+ G021+ H003+ H097+ O005+ P046+ P054+ P074+ P105+ T021+ T022+ T122+ N044+ Pages Related to Peak C2H5O: C044+ E023+ Pages Related to Peak C2H6N: A011+ A015+ S014+ T004+ E023+ M034+ T021+ T030+ A155+ Pages Related to Peak C2H4N: S014+ I046+ S011+ T051+

[show] About the PP Table (行列表示について)

[hide] KOX00698p	106 C4H12NO2	88 C4H10NO	70 C4H8N	45 C2H5O	44 C2H6N	42 C2H4N
106 C4H12NO2
88 C4H10NO	H2O
70 C4H8N	H4O2	H2O
45 C2H5O	C2H7NO	C2H5N
44 C2H6N	C2H6O2	C2H4O	C2H2
42 C2H4N	C2H8O2	C2H6O	C2H4		H2

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