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Peak #8854 MN MID: SE61_S21_M90

m/z: 509.27193, RT: 72.88, 強度: 37095, ログ強度: 0.98, アダクト: [M+Na]+, 共有数（同様のピークを含むサンプル数）: 4

DB検索結果: (8 names) DG(2:0/0:0/6 keto-PGF1alpha);DG(2:0/TXB2/0:0);10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside;DG(2:0/6 keto-PGF1alpha/0:0);DG(2:0/0:0/TXB2);DG(TXB2/2:0/0:0);1-(7Z,10Z,13Z-hexadecatrien...

DBごとのヒット数: ALL 8 KN 1 HM 6 LM 1

FlavonoidSearch最大スコア MS2: 0.100, MS3: -

組成式	分子量	誤差(Δppm）	候補化合物名（代表で最短名を記載）	化合物ID
C25H42O9	486.28288	-0.368	DG(2:0/0:0/6 keto-PGF1alpha)	HMDB: HMDB0296913, HMDB0296914
C25H42O9	486.28288	-0.368	DG(2:0/TXB2/0:0)	HMDB: HMDB0296931
C25H42O9	486.28288	-0.368	10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside	KNApSAcK: C00019369
C25H42O9	486.28288	-0.368	DG(2:0/6 keto-PGF1alpha/0:0)	HMDB: HMDB0296911
C25H42O9	486.28288	-0.368	DG(2:0/0:0/TXB2)	HMDB: HMDB0296933, HMDB0296934
C25H42O9	486.28288	-0.368	DG(TXB2/2:0/0:0)	HMDB: HMDB0296932
C25H42O9	486.28288	-0.368	1-(7Z,10Z,13Z-hexadecatrienoyl)-3-O-beta-D-galactosyl-sn-glycerol	LipidMAPS: LMGL04010009
C25H42O9	486.28288	-0.368	DG(6 keto-PGF1alpha/2:0/0:0)	HMDB: HMDB0296912

MSnスペクトル情報

Level: 2, プリカーサーm/z: 509.27191

Splash: splash10-0zfr-0193200000-d27d53daf496b2ae06a0

m/z	Int.	NL	Rel.Int.
203.11	674	306	1000
259.13	580	250	860
347.34	346	162	513
185.14	186	324	275
491.34	132	18	196
453.24	123	56	182
401.12	70	108	104
329.34	42	180	62
363.29	42	146	61
435.27	34	74	50

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.100	[Dihydroflavonol]-A(2OH, 1(C-Prenyl))-B(2OH, 2(C-Prenyl))	Dihydroflavonol	Petalostemumol
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(2OH, 1Geranyl)	Flavanone	Tanariflavanone A
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1Lavandulyl)-B(3OH)	Flavanone	Exiguaflavanone J
0.000	[Flavanone]-A(2OH, 1(C-Prenyl), 1Geranyl)-B(3OH)	Flavanone	Tomentosanol E
0.000	[Dihydroflavonol]-A(2OH, 1(C-Prenyl), 1Lavandulyl)-B(2OH)	Dihydroflavonol	Kushenol M
0.000	[Dihydroflavonol]-A(2OH, 1(C-Prenyl))-B(2OH, 1Geranyl)	Dihydroflavonol	Sanggenol K
0.000	[Dihydroflavonol]-A(2OH)-B(2OH, 1(C-Prenyl), 1Geranyl)	Dihydroflavonol	Sanggenol D

Level: 3, プリカーサーm/z: 259.13278

Splash: splash10-0udi-0090000000-df5ab1ecf2aa62d8c473

m/z	Int.	NL	Rel.Int.
203.07	41	56	1000

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Isoflavan]-A(1OH)-B(2OH)	Isoflavan	Demethylvestitol
[Dihydrochalcone]-A(2OH)-B(1OH)	Dihydrochalcone	Davidigenin
[Dihydrochalcone]-A(3OH)-B(none)	Dihydrochalcone	2',4',6'-Trihydroxydihydrochalcone
[Dihydrochalcone]-A(1OH)-B(2OH)	Dihydrochalcone	2,4,4'-Trihydroxydihydrochalcone
[Flavan 3-ol]-A(2OH)-B(none)	Flavan 3-ol	Distenin
[Flavan 3-ol]-A(1OH)-B(1OH)	Flavan 3-ol	Guibourtinidol
[2-Benzyldihydrobenzofuran]-A(1OH)-B(1OH)	2-Benzyldihydrobenzofuran	3,6,4'-Trihydroxy-2-benzyldihydrobenzofuran
[Flavan]-A(2OH)-B(1OH)	Flavan	Apigeniflavan

関連ピーク情報

ピーク番号	保持時間 (min)	m/z	m/z差分	ログ強度	アダクト	DB検索結果	ヒット数	MSn	FS2	FS3	共有数
	72.86	525.24572	15.9738	1.03	[M+K]+	(8 names) DG(2:0/0:0/6 keto-PGF1alpha); DG(2:0/TXB2/0:0); 10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside; DG(2:0/6 keto-PGF1alpha/0:0); DG(2:0/0:0/TXB2); DG(TXB2/2:0/0:0); 1-(7Z,10Z,13Z-hexadecatrien...	ALL 8 KN 1 HM 6 LM 1	MS2 MS3			4
8854	72.88	509.27193	0.0000	0.98	[M+Na]+	(8 names) DG(2:0/0:0/6 keto-PGF1alpha); DG(2:0/TXB2/0:0); 10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside; DG(2:0/6 keto-PGF1alpha/0:0); DG(2:0/0:0/TXB2); DG(TXB2/2:0/0:0); 1-(7Z,10Z,13Z-hexadecatrien...	ALL 8 KN 1 HM 6 LM 1	MS2 MS3	0.100		4
	72.80	504.31638	-4.9555	1.25	[M+NH4]+	(8 names) DG(2:0/0:0/6 keto-PGF1alpha); DG(2:0/TXB2/0:0); 10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside; DG(2:0/6 keto-PGF1alpha/0:0); DG(2:0/0:0/TXB2); DG(TXB2/2:0/0:0); 1-(7Z,10Z,13Z-hexadecatrien...	ALL 8 KN 1 HM 6 LM 1	MS2 MS3			6
	72.82	487.28987	-21.9821	1.35	[M+H]+	(8 names) DG(2:0/0:0/6 keto-PGF1alpha); DG(2:0/TXB2/0:0); 10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside; DG(2:0/6 keto-PGF1alpha/0:0); DG(2:0/0:0/TXB2); DG(TXB2/2:0/0:0); 1-(7Z,10Z,13Z-hexadecatrien...	ALL 8 KN 1 HM 6 LM 1	MS2 MS3	0.100		3
	72.81	469.27924	-39.9927	1.44	[M-H2O+H]+	(8 names) DG(2:0/0:0/6 keto-PGF1alpha); DG(2:0/TXB2/0:0); 10,11-Dihydro-12-hydroxynerolidol 3-O-beta-D-2'-acetylglucoside; DG(2:0/6 keto-PGF1alpha/0:0); DG(2:0/0:0/TXB2); DG(TXB2/2:0/0:0); 1-(7Z,10Z,13Z-hexadecatrien...	ALL 8 KN 1 HM 6 LM 1	MS2 MS3 x 2		0.038	5

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

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