ピーク情報

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Peak #1131 MN MID: SE172_S070121_M90

m/z: 343.12332, RT: 11.92, 強度: 61811, ログ強度: 1.44, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 149

DB検索結果: (25 names) Lactulose;Sakebiose;Nigerose;Inulobiose;Trehalose;Turanose;Gentiobiose;Isomaltulose;Sakebiose;Lactose;Melibiose;Sophorose;Trehalulose;Kojibiose;Sucrose;Maltulose;4-O-alpha-D-Glucopyranosyl-D-fructose;...

DBごとのヒット数: ALL 23 KG 15 KN 4 HM 4

FlavonoidSearch最大スコア MS2: 0.071, MS3: 0.062

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
C12H22O11	342.11621	-0.492	Lactulose	HMDB: HMDB0000740 KEGG: C07064
C12H22O11	342.11621	-0.492	Sakebiose	HMDB: HMDB0006603, HMDB0259415 KNApSAcK: C00050493
C12H22O11	342.11621	-0.492	Inulobiose	HMDB: HMDB0029898, HMDB0304763 KEGG: C01711
C12H22O11	342.11621	-0.492	Trehalose	HMDB: HMDB0000975, HMDB0029880 KEGG: C01083 KNApSAcK: C00001152
C12H22O11	342.11621	-0.492	Gentiobiose	HMDB: HMDB0259486 KNApSAcK: C00018660, C00053253
C12H22O11	342.11621	-0.492	Turanose	HMDB: HMDB0011740, HMDB0260157 KEGG: C19636 KNApSAcK: C00053105
C12H22O11	342.11621	-0.492	Melibiulose	HMDB: HMDB0247101 KEGG: C19634 KNApSAcK: C00053368
C12H22O11	342.11621	-0.492	Nigerose	HMDB: HMDB0029882, HMDB0060068, HMDB0242694 KEGG: C01518, C02048, C04147, C19773, C22512 KNApSAcK: C00001137
C12H22O11	342.11621	-0.492	beta-Lactose	HMDB: HMDB0000055, HMDB0000163, HMDB0000186, HMDB0029902, HMDB0029933, HMDB0033368, HMDB0037138, HMDB0041627, HMDB0246552 KEGG: C01970, C01971, C06422, C20861, C00185, C00208, C00897, C02964, C00243, C06421, C20236, C22492 KNApSAcK: C00001134, C00001136, C00001140, C00050427
C12H22O11	342.11621	-0.492	Melibiose	HMDB: HMDB0000048, HMDB0002923, HMDB0006792, HMDB0038489, HMDB0248216 KEGG: C00252, C01728, C05402, C08240, C05400 KNApSAcK: C00001142
C12H22O11	342.11621	-0.492	Sophorose	HMDB: HMDB0252573 KEGG: C08250, C15548, C22632, C21336 KNApSAcK: C00001149
C12H22O11	342.11621	-0.492	Trehalulose	HMDB: HMDB0039727
C12H22O11	342.11621	-0.492	Kojibiose	HMDB: HMDB0011742 KEGG: C19632 KNApSAcK: C00050477
C12H22O11	342.11621	-0.492	Sucrose	HMDB: HMDB0000258, HMDB0246276 KEGG: C00089, C18068, C04219 KNApSAcK: C00001151
C12H22O11	342.11621	-0.492	Maltulose	KEGG: C19633
C12H22O11	342.11621	-0.492	beta-D-Galf-(1->5)-beta-D-galactofuranoside	KEGG: C22958
C12H22O11	342.11621	-0.492	(3S,4R,5S)-3,4,5,6-Tetrahydroxy-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexan-2-one	HMDB: HMDB0260158
C12H22O11	342.11621	-0.492	Palatinose	HMDB: HMDB0256083 KEGG: C01742
C12H22O11	342.11621	-0.492	4-O-beta-D-Mannopyranosyl-D-mannose	HMDB: HMDB0242553 KNApSAcK: C00053459
C12H22O11	342.11621	-0.492	Difructan	KNApSAcK: C00055102
C12H22O11	342.11621	-0.492	Galactinol	HMDB: HMDB0005826, HMDB0039876 KEGG: C01235 KNApSAcK: C00001162, C00038295
C12H22O11	342.11621	-0.492	Levanbiose	KEGG: C01725
C12H22O11	342.11621	-0.492	Glucinol	HMDB: HMDB0039237
C12H22O11	342.11621	-0.492	Maltulose	HMDB: HMDB0029919

MSnスペクトル情報

Level: 2, プリカーサーm/z: 343.12314

Splash: splash10-00di-0019000000-f188e0e7d01ae4d2c519

m/z	Int.	NL	Rel.Int.
324.93	3084	18	1000
325.86	443	17	143
289.89	391	53	126
211.11	181	132	58

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.071	[Flavone]-A(1OH)-B(3OH)	Flavone	7,2',4',5'-Tetrahydroxyflavone
0.043	[Isoflavone]-A(1OMe)-B(3OMe)	Isoflavone	7,2',4',5'-Tetramethoxyisoflavone
0.043	[Isoflavone]-A(2OMe)-B(2OMe)	Isoflavone	6,7,3',4'-Tetramethoxyisoflavone
0.000	[Flavone]-A(2OMe)-B(2OMe)	Flavone	Zapotin
0.000	[Flavone]-A(2OMe)-B(2OMe)	Flavone	Cerrosillin
0.000	[Flavone]-A(2OMe)-B(2OMe)	Flavone	5,7,2',5'-tetramethoxyflavone
0.000	[Flavone]-A(2OMe)-B(2OMe)	Flavone	Luteolin 5,7,3',4'-tetramethyl ether
0.000	[Flavone]-A(2OMe)-B(2OMe)	Flavone	Norartocarpetin 5,7,2',4'-tetramethyl ether
0.000	[Flavone]-A(3OMe)-B(1OMe)	Flavone	Scutellarein 5,6,7,4'-tetramethyl ether
0.000	[Flavone]-A(3OMe)-B(1OMe)	Flavone	4',5,7,8-Tetramethoxyflavone
0.000	[Flavone]-A(4OMe)-B(none)	Flavone	5,6,7,8-Tetramethoxyflavone
0.000	[Aurone]-A(2OMe)-B(2OMe)	Aurone	4,6,3',4'-Tetramethoxyaurone
0.000	[Chalcone]-A(3OMe)-B(1([@@]-Methylenedioxy))	Chalcone	3,4-Methylenedioxy-2',4',6'-trimethoxychalcone
0.000	[alpha-Methyl-beta-oxodihydrochalcone]-A(2OMe)-B(1Oxo, 1Methyl, 1([@@]-Methylenedioxy))	alpha-Methyl-beta-oxodihydrochalcone	Tinosporinone
0.000	[Flavanone]-A(1OH, 1(3-hydroxy-3-methylbutyl))-B(1OH)	Flavanone	Brosimacutin C
0.000	[Flavone]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	Flavone	2-(1,3-Benzodioxol-5-yl)-5-hydroxy-6,8-dimethoxy-4H-1-benzopyran-4-one
0.000	[Flavone]-A(2OH, 2Methyl)-B(2OMe)	Flavone	5,7-Dihydroxy-3',4'-dimethoxy-6,8-dimethylflavone
0.000	[Flavonol (3-OMe)]-A(1OMe)-B(2OMe)	Flavonol	Fisetin tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(2OMe)-B(1OMe)	Flavonol	Tetramethylkaempferol
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe, 1Methyl)-B(1OMe)	Flavonol	8-Desmethylkalmiatin
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe, 2Methyl)-B(1OH)	Flavonol	6,8-Di-C-methylkaempferol 3,7-dimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1([@@]-Methylenedioxy))	Flavonol	5-Hydroxy-3,7-dimethoxy-3',4'-methylenedioxyflavone
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(none)	Flavonol	3,5,6,7-Tetramethoxyflavone
0.000	[Flavonol]-A(1OMe, 1([@@]-Methylenedioxy))-B(1OMe)	Flavonol	3-Hydroxy-5,4'-dimethoxy-6,7-methylenedioxyflavone
0.000	[Flavonol (3-OMe)]-A(3OMe)-B(none)	Flavonol	3,5,7,8-Tetramethoxyflavone
0.000	[Flavan 3-ol]-A(1OH, 1([2,3:@@]-(6-Oxopyrano)))-B(2OH)	Flavan 3-ol	Phyllocoumarin
0.000	[Isoflavone]-A(1OH, 1OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	6-Hydroxy-7,2'-dimethoxy-4',5'-methylenedioxyisoflavone
0.000	[Isoflavone]-A(1OH, 1OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	Dalpatein
0.000	[Isoflavone]-A(1OH, 1OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	Maximaisoflavone F
0.000	[Isoflavone]-A(1OH, 1OMe, 1Methyl)-B(2OMe)	Isoflavone	5-Hydroxy-7,3',4'-trimethoxy-8-methylisoflavone
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(1OH, 1OMe)	Isoflavone	Isoiriskashmirianin
0.000	[Isoflavone]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	Isoflavone	Dipteryxine
0.000	[Isoflavone]-A(1OH, 1([@@]-Methylenedioxy))-B(2OMe)	Isoflavone	Squarrosin
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(1OH, 1OMe)	Isoflavone	Iriskashmirianin
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(1OH, 1OMe)	Isoflavone	Iriskumaonin
0.000	[Isoflavone]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	Isoflavone	Platycarpanetin
0.000	[Pterocarpene]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	Pterocarpene	Leiocalycin
0.000	[Pterocarpene]-A(1OMe)-B(3OMe)	Pterocarpene	Bryacarpene 3
0.000	[Rotenone]-A(1OMe)-B(2OMe)	Rotenone	Munduserone
0.000	[4-phenylcoumarin]-A(1OH, 1OMe, 1Formyl)-B(1OH, 1OMe)	4-phenylcoumarin	7,3'-Dihydroxy-5,4'-dimethoxy-6-formyl-4-phenylcoumarin
0.000	[4-phenylcoumarin]-A(1OH, 1OMe, 1Formyl)-B(1OH, 1OMe)	4-phenylcoumarin	Sisafolin

Level: 3, プリカーサーm/z: 324.97180

Splash: splash10-00di-0093000000-454794120a86c18d365e

m/z	Int.	NL	Rel.Int.
270.95	37	54	1000
307.22	16	18	425
648.65	4	-324	107

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.063	[Flavanone]-A(2OH, 1(C-Prenyl))-B(none)	Flavanone	Glabranin
0.063	[Flavanone]-A(2OH, 1(C-Prenyl))-B(none)	Flavanone	5,7-Dihydroxy-6-C-prenylflavanone
0.063	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH)	Flavanone	Crotaramosmin
0.063	[2'-Hydroxychalcone]-A(3OH, 1(C-Prenyl))-B(none)	2'-Hydroxychalcone	Desmethylisoxanthohumol
0.053	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH)	Flavanone	Isobavachin
0.053	[Flavanone]-A(1OH, 1(C-Prenyl))-B(1OH)	Flavanone	Bavachin
0.053	[Flavanone]-A(1OH)-B(1OH, 1(C-Prenyl))	Flavanone	Abyssinone II
0.053	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	Isobavachalcone
0.053	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(1OH)	2'-Hydroxychalcone	Broussochalcone B
0.053	[2'-Hydroxychalcone]-A(2OH)-B(1OH, 1(C-Prenyl))	2'-Hydroxychalcone	Licoagrochalcone A
0.000	[Pterocarpan]-A(1OH, 1(C-Prenyl))-B(1OH)	Pterocarpan	2-Prenyldemethylmedicarpin
0.000	[Pterocarpan]-A(1OH)-B(1OH, 1(C-Prenyl))	Pterocarpan	8-Prenyldemethylmedicarpin
0.000	[Pterocarpan]-A(1OH)-B(1OH, 1(C-Prenyl))	Pterocarpan	Phaseollidin
0.000	[Chalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1OH)	Chalcone	Crotmadine
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(none)	2'-Hydroxychalcone	Flemistrictin E
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(none)	2'-Hydroxychalcone	Flemistrictin B
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(none)	2'-Hydroxychalcone	Flemistrictin F
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(none)	2'-Hydroxychalcone	Flemistrictin C
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1OH)	2'-Hydroxychalcone	Dorsmanin A
0.000	[Dihydrochalcone]-A(2OH, 1([2,3:@@]-(6-Methyl-4,7-dihydrooxepino)))-B(none)	Dihydrochalcone	1-(2,5-dihydro-6,8-dihydroxy-3-methyl-1-benzoxepin-7-yl)-3-phenyl-1-propanone
0.000	[Flavanone]-A(1OH, 1(3-Hydroxy-3-methyl-1-butenyl))-B(none)	Flavanone	7-Hydroxy-8-C-(3-hydroxy-3-methyl-trans-buten-1-yl)flavanone
0.000	[Flavanone]-A(2OMe, 1([2,3:@@]-Furano))-B(none)	Flavanone	5,6-Dimethoxy-[2'',3'':7,8]furanoflavanone
0.000	[Isoflavanone]-A(1([2,3:@@]-Furano))-B(2OMe)	Isoflavanone	Neoraunone
0.000	[Isoflavan]-A(1OH)-B(1OH, 1([2,3:@@]-(5-Isopropenyldihydrofurano)))	Isoflavan	Crotmarine
0.000	[Isoflavan]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH)	Isoflavan	Glabridin
0.000	[Isoflavan]-A(1OH)-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Isoflavan	Phaseollinisoflavan
0.000	[Pterocarpan]-A(1([2,3:@@]-Furano))-B(2OMe)	Pterocarpan	Ambonane
0.000	[Pterocarpan-6a-ol]-A(1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Pterocarpan-6a-ol	Neobanol

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
	12.06	384.15013	41.0268	0.41	[M+ACN+H]+	(25 names) Lactulose; Sakebiose; Nigerose; Inulobiose; Trehalose; Turanose; Gentiobiose; Isomaltulose; Sakebiose; Lactose; Melibiose; Sophorose; Trehalulose; Kojibiose; Sucrose; Maltulose; 4-O-alpha-D-Glucopyranosyl-D-fructose; ...	ALL 23 KG 15 KN 4 HM 4				68
	12.32	381.07892	37.9556	1.83	[M+K]+	(25 names) Lactulose; Sakebiose; Nigerose; Inulobiose; Trehalose; Turanose; Gentiobiose; Isomaltulose; Sakebiose; Lactose; Melibiose; Sophorose; Trehalulose; Kojibiose; Sucrose; Maltulose; 4-O-alpha-D-Glucopyranosyl-D-fructose; ...	ALL 23 KG 15 KN 4 HM 4	MS2 MS3			170
	12.10	363.06869	19.9454	0.54	[M-H2O+K]+	(25 names) Lactulose; Sakebiose; Nigerose; Inulobiose; Trehalose; Turanose; Gentiobiose; Isomaltulose; Sakebiose; Lactose; Melibiose; Sophorose; Trehalulose; Kojibiose; Sucrose; Maltulose; 4-O-alpha-D-Glucopyranosyl-D-fructose; ...	ALL 23 KG 15 KN 4 HM 4				103
1131	11.92	343.12332	0.0000	1.44	[M+H]+	(25 names) Lactulose; Sakebiose; Nigerose; Inulobiose; Trehalose; Turanose; Gentiobiose; Isomaltulose; Sakebiose; Lactose; Melibiose; Sophorose; Trehalulose; Kojibiose; Sucrose; Maltulose; 4-O-alpha-D-Glucopyranosyl-D-fructose; ...	ALL 23 KG 15 KN 4 HM 4	MS2 MS3	0.071	0.063	149
	12.06	342.13941	-0.9839	1.23	[M+NH4]+, [M-H2O+NH4]+	(4 names) Difructose anhydride III; Bis-D-fructose 2',1:2,1'-dianhydride; Difructose anhydride I; Furaltadone	ALL 3 KG 3	MS2 MS3		0.067	91
	12.06	325.11256	-18.0108	2.88	[M+H]+, [M-H2O+H]+	(3 names) Difructose anhydride III; Bis-D-fructose 2',1:2,1'-dianhydride; Difructose anhydride I	ALL 2 KG 2	MS2 MS3 x 2	0.095	0.083	157

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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