ピーク情報

＜調味料類＞（だし類）昆布だし

pos

Peak #1102 MN MID: SE119_S170201_M90

m/z: 307.08292, RT: 18.68, 強度: 13089, ログ強度: 0.76, アダクト: [M+2H]2+, 共有数（同様のピークを含むサンプル数）: 75

DB検索結果: Oxidized glutathione

DBごとのヒット数: ALL 1 KG 1

FlavonoidSearch最大スコア MS2: 0.036, 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
C20H32O12N6S2	612.15196	-1.103	Glutathione disulfide	HMDB: HMDB0003337 KEGG: C00127

Level: 2, プリカーサーm/z: 307.08298

Splash: splash10-056s-0494300000-f690db02aa7b372c6ac2

m/z	Int.	NL	Rel.Int.
129.84	64278	177	1000
298.58	58555	9	910
355.03	54726	-48	851
484.05	40641	-177	632
275.64	33039	31	513
242.79	23409	64	364
269.64	23291	37	362
538.11	10721	-231	166
356.09	8870	-49	137
485.14	8069	-178	125
409.03	7283	-102	113
357.14	5961	-50	92
381.03	4110	-74	63
299.66	3923	7	61
130.97	3489	176	54
276.66	3408	30	53

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavan 3-ol]-A(2OH)-B(3OH)	Flavan 3-ol	Gallocatechin
[Flavanone]-A(1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavanone	Isolonchocarpin
[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	2'-Hydroxychalcone	Lonchocarpin
[Aurone]-A(1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Aurone	3',4'-Methylenedioxyfurano[2'',3'':6,7]aurone
[Flavan 3,4-diol]-A(1OH)-B(3OH)	Flavan 3,4-diol	3,4,7,3',4',5'-Hexahydroxyflavan
[Flavan 3,4-diol]-A(2OH)-B(2OH)	Flavan 3,4-diol	3,4,7,8,3',4'-Hexahydroxyflavan
[Flavan 3,4-diol]-A(2OH)-B(2OH)	Flavan 3,4-diol	Catechin-4-ol
[Pterocarpene]-A(1([2,3:@@]-Furano))-B(1([@@]-Methylenedioxy))	Pterocarpene	Neoduleen

Level: 3, プリカーサーm/z: 129.84929

Splash: splash10-001i-9000000000-7db45ff91bc84ca49b09

m/z	Int.	NL	Rel.Int.
83.85	9160	46	1000

Level: 3, プリカーサーm/z: 298.56949

Splash: splash10-052f-0090000000-9d3476d2d38894794b05

m/z	Int.	NL	Rel.Int.
290.06	3062	9	1000
257.02	1576	42	514
267.00	1483	32	484
129.82	786	169	256
260.35	342	38	111
257.98	267	41	87
264.90	238	34	77
290.78	183	8	59
269.57	163	29	53

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Coumestan]-A(1OH)-B(1OH, 1OMe)	Coumestan	8-Methoxycoumestrol
[Coumestan]-A(1OH)-B(1OH, 1OMe)	Coumestan	Trifoliol
[Coumestan]-A(1OH, 1OMe)-B(1OH)	Coumestan	Sativol
[Flavone]-A(1OH, 1([@@]-Methylenedioxy))-B(1OH)	Flavone	Kanzakiflavone 2
[CCS-type derivative / [3,2']-Epoxymethanoflavone]-A(1OH)-B(2OH)	CCS-type derivative / [3,2']-Epoxymethanoflavone	Peltogynin
[CCS-type derivative / [3,2']-Epoxymethanoflavone]-A(1OH)-B(2OH)	CCS-type derivative / [3,2']-Epoxymethanoflavone	Mopanin
[Isoflavone]-A(1OH)-B(1OH, 1([@@]-Methylenedioxy))	Isoflavone	2-Hydroxypseudobaptigenin
[Isoflavone]-A(1OH)-B(1OH, 1([@@]-Methylenedioxy))	Isoflavone	Glyzaglabrin
[Isoflavone]-A(2OH)-B(1([@@]-Methylenedioxy))	Isoflavone	5-Hydroxypseudobaptigenin
[Isoflavone]-A(1OH, 1([@@]-Methylenedioxy))-B(1OH)	Isoflavone	Irisone B
[Isoflavone]-A(1OH, 1([@@]-Methylenedioxy))-B(1OH)	Isoflavone	Irilone
[UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavone]-A(1OH)-B(1OMe)	UBR-type derivative / [2',5']-Benzoquinonyl-type Isoflavone	Bowdichione
[3-Phenylcoumarin]-A(1OH)-B(1OH, 1([@@]-Methylenedioxy))	3-Phenylcoumarin	7,2'-Dihydroxy-4',5'-methylenedioxy-3-phenylcoumarin
[CCS-type derivative / [5,2']-Epoxy-4-phenylcoumarin]-A(1OMe)-B(2OH)	CCS-type derivative / [5,2']-Epoxy-4-phenylcoumarin	4',5'-Dihydroxy-7-methoxy-5,2'-oxido-4-phenylcoumarin

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
	18.69	613.15870	306.0758	0.71	[M+H]+	Oxidized glutathione	ALL 1 KG 1	MS2			89
1102	18.68	307.08292	0.0000	0.76	[M+2H]2+	Oxidized glutathione	ALL 1 KG 1	MS2 MS3 x 2	0.036		75