ピーク情報

イネ　葉　コシヒカリ

pos

Peak #3640 MN MID: SE199_S31_M90

m/z: 831.23628, RT: 44.29, 強度: 18258, ログ強度: 0.71, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 2

DB検索結果: (4 names) Uroporphyrin III;Uroporphyrin I;Uroporphyrin IV;Alatanin 2

DBごとのヒット数: ALL 4 KG 2 KN 1 HM 1

FlavonoidSearch最大スコア MS2: -, MS3: 1.000

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
C40H38O16N4	830.22828	0.871	Uroporphyrin III	HMDB: HMDB0000916
C40H38O16N4	830.22828	0.871	Uroporphyrin I	KEGG: C05767
C40H38O16N4	830.22828	0.871	Uroporphyrin I	HMDB: HMDB0000936
C40H38O16N4	830.22828	0.871	Uroporphyrin IV	HMDB: HMDB0000890
C40H38O16N4	830.22828	0.871	Uroporphyrin III	KEGG: C02469
C39H42O20	830.22694	2.482	Alatanin 2	FlavonoidViewer: [1]FL7AADGL0016 HMDB: [1]HMDB0038826 KNApSAcK: [1]C00006864 LipidMAPS: [1]LMPK12010247

MSnスペクトル情報

Level: 2, プリカーサーm/z: 831.23596

Splash: splash10-03dj-0007902000-28ca260ccb8b5070da52

m/z	Int.	NL	Rel.Int.
463.18	5319	368	1000
445.16	3123	386	587
343.19	2650	488	498
367.20	1720	464	323
313.17	1564	518	294
397.14	1315	434	247
669.04	1292	162	242
409.21	1125	422	211
813.29	1078	18	202
427.23	777	404	145
651.20	689	180	129
625.10	573	206	107
301.06	471	530	88
339.11	402	492	75
369.11	397	462	74
711.03	346	120	65
391.24	329	440	61
795.11	284	36	53
379.14	266	452	50

Level: 3, プリカーサーm/z: 463.12860

Splash: splash10-0002-0004900000-1bc6cca7bde8b7ad885a

m/z	Int.	NL	Rel.Int.
445.16	3266	18	1000
397.24	966	66	295
427.23	521	36	159
367.19	466	96	142
343.21	425	120	130
409.20	388	54	118

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
1.000	[Flavone]-A(2OH, 1(C-Glu))-B(1OH, 1OMe)	Flavone	Isoscoparin
1.000	[Flavone]-A(2OH, 1(C-Glu))-B(1OH, 1OMe)	Flavone	6-C-beta-D-Glucopyranosyldiosmetin
1.000	[Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(2OH)	Flavone	Swertiajaponin
1.000	[Flavone]-A(2OH, 1(C-Glu))-B(1OH, 1OMe)	Flavone	Scoparin
1.000	[Flavone]-A(2OH, 1(C-Glu))-B(1OH, 1OMe)	Flavone	8-C-beta-D-Glucopyranosyldiosmetin
1.000	[Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(2OH)	Flavone	Parkinsonin A
1.000	[Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(2OH)	Flavone	Isoswertiajaponin
1.000	[Flavonol]-A(1OH, 1OMe, 1(C-Glu))-B(1OH)	Flavonol	Keyakinin
1.000	[Isoflavone]-A(2OH, 1(C-Glu))-B(1OH, 1OMe)	Isoflavone	Dalpanitin
0.000	[Flavone]-A(4OMe)-B(4OMe)	Flavone	Agehoustin A
0.000	[UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Dihydrochalcone]-A(2OH, 3(C-Prenyl))-B(none)	UBR-type derivative / 2'-Oxocyclohexa-4',6'-dienyl-type Dihydrochalcone	Helilupolone
0.000	[Flavonol]-A(1OH, 1OMe, 1(C-Rhamnosyl))-B(2OH)	Flavonol	6-C-Rhamnopyranosylrhamnetin
0.000	[Flavonol (3-OMe)]-A(4OMe)-B(3OMe)	Flavonol	Exoticin
0.000	[Flavonol (3-OMe)]-A(4OMe)-B(3OMe)	Flavonol	Purpurascenin
0.000	[Flavan]-A(1OH, 1(1,1-Dimethylallyl))-B(2OH, 2(C-Prenyl))	Flavan	Kazinol E
0.000	[Flavan]-A(1OH, 1(1,1-Dimethylallyl))-B(2OH, 2(C-Prenyl))	Flavan	Kazinol Q
0.000	[CCS-type derivative / [2,3,4:5,4a,4]-(6-Phenylpyrano)anthocyanidin (3',4'-Dihydroxy)]-A(1OH)-B(1OH, 2OMe)	CCS-type derivative / [2,3,4:5,4a,4]-(6-Phenylpyrano)anthocyanidin	Malvidin 4-vinylcatechol
0.000	[Isoflavone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	Euchrenone b3

Level: 3, プリカーサーm/z: 445.20886

Splash: splash10-0691-0009400000-ca599ebafddc7ee73cb5

m/z	Int.	NL	Rel.Int.
367.24	780	78	1000
397.20	693	48	888
427.16	425	18	545
409.25	391	36	501
325.22	128	120	164
313.07	116	132	148
391.31	41	54	52

ピーク情報

DB検索結果

MSnスペクトル情報

FlavonoidSearch結果

FlavonoidSearch結果

FlavonoidSearch結果

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Flavone]-A(1OH, 1OMe, 1(C-Rhamnosyl))-B(1OMe)	Flavone	7-Hydroxy-5,4'-dimethoxyflavone 8-C-rhamnoside
[Flavone]-A(2OH, 1(3,4-Dihydroxy-6-methyl-5-oxotetrahydro-2-pyranyl))-B(1OH, 1OMe)	Flavone	3'-O-Methylderhamnosylmaysin
[Flavone]-A(2OH, 1(6-Deoxy-beta-L-ribo-hexopyranos-3-ulos-1-yl))-B(1OH, 1OMe)	Flavone	6-C-(6-Deoxy-ribo-hexos-3-ulosyl)diosmetin
[UBR-type derivative / [3',6']-Benzoquinonyl-type [2',3]-Isopropenylethenoflavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OMe)	UBR-type derivative / [3',6']-Benzoquinonyl-type [2',3]-Isopropenylethenoflavone	Artomunoxanthentrione
[Isoflavone]-A(1OH, 1OMe, 1(C-Rhamnosyl))-B(1OMe)	Isoflavone	Isovolubilin
[Isoflavone]-A(1OH, 1OMe, 1(C-Rhamnosyl))-B(1OMe)	Isoflavone	Volubilin