ピーク情報

＜貝類＞ほたてがい生

pos

Peak #2229 MN MID: SE114_S103111_M90

m/z: 491.33261, RT: 36.03, 強度: 5418, ログ強度: 0.43, アダクト: [2M+H]+, 共有数（同様のピークを含むサンプル数）: 1

DB検索結果: (7 names) Isovalerylcarnitine;Pivaloylcarnitine;2-Methylbutyroylcarnitine;alpha-5-C-(3-Hydroxybutyl)-hyacinthacine A2;(-)-alpha-5-C-(3-Hydroxybutyl)-hyacinthacine A2;Valerylcarnitine;Pinacidil

DBごとのヒット数: ALL 6 KG 2 KN 1 LM 3

FlavonoidSearch最大スコア MS2: -, 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
C12H23O4N	245.16271	-0.161	Isovalerylcarnitine	HMDB: HMDB0000688 KEGG: C20826 LipidMAPS: LMFA07070076, LMFA07070077
C12H23O4N	245.16271	-0.161	Pivaloylcarnitine	HMDB: HMDB0041993 LipidMAPS: LMFA07070103
C12H23O4N	245.16271	-0.161	2-Methylbutyroylcarnitine	HMDB: HMDB0000378 LipidMAPS: LMFA07070034
C12H23O4N	245.16271	-0.161	alpha-5-C-(3-Hydroxybutyl)-hyacinthacine A2	KNApSAcK: C00038411
C12H23O4N	245.16271	-0.161	Valerylcarnitine	HMDB: HMDB0013128 LipidMAPS: LMFA07070111

MSnスペクトル情報

Level: 2, プリカーサーm/z: 491.33197

Splash: splash10-0002-0090000000-2616043d1e914d12b669

m/z	Int.	NL	Rel.Int.
246.15	4365	245	1000

FlavonoidSearch結果

Symbolized Name	MSMS-Category	MSMS-Aglycone
[Isoflavone]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl))	Isoflavone	Euchrenone b2
[Flavone]-A(2OH, 2(C-Prenyl))-B(2OH, 1(C-Prenyl))	Flavone	Dorsilurin A
[Flavone]-A(1OH, 1OMe, 1(C-Glu))-B(2OMe)	Flavone	Isoorientin 7,3',4'-trimethyl ether
[Dihydrochalcone]-A(2OH, 1OMe, 1(1-(2-Hydroxy-5-methoxycarbonylphenyl)-3-methylbut-2-enyl))-B(none)	Dihydrochalcone	Piperaduncin A
[Flavanone]-A(2OH, 1(C-Prenyl), 1(6-Ethyl-4-hydroxy-5-methyl-2-oxo-2H-pyran-3-yl))-B(none)	Flavanone	8-Prenyllepidissipyrone
[Flavanone]-A(2OH, 2(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Amorinin
[Flavanone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(2OH, 1(C-Prenyl))	Flavanone	Amoridin
[Flavanone]-A(2OH, 1(C-Prenyl))-B(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))	Flavanone	Tanariflavanone B
[Flavanone]-A(2OH, 2(C-Prenyl))-B(1OH, 1([2,3:@@]-(6,6-Dimethylpyrano)))	Flavanone	Euchrenone a6
[Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 2''-O-acetate
[Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Isoorientin 6''-O-acetate
[Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Orientin 2''-O-acetate
[Flavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Flavone	Orientin 6''-O-acetate
[3-substituted Flavone (3-C-Prenyl)]-A(2OH, 2(C-Prenyl))-B(2OH)	3-substituted Flavone	Artelasticin
[3-substituted Flavone (3-Geranyl)]-A(2OH, 1(C-Prenyl))-B(2OH)	3-substituted Flavone	Rubraflavone C
[3-substituted Flavone (3-Geranyl)]-A(2OH, 1(C-Prenyl))-B(2OH)	3-substituted Flavone	Artocommunol CD
[Flavone]-A(2OH, 1Farnesyl)-B(2OH)	Flavone	Moralbanone
[UBR-type derivative / 2'-Oxo, 4-hydroxy-(2,1'),(3,4)-butadiene-type 3-substituted Flavone ([2,3:4,3]-(6,6-Dimethyldihydropyrano))]-A(2([2,3:@@]-(6,6-Dimethylpyrano)))-B(1OH)	UBR-type derivative / 2'-Oxo, 4-hydroxy-(2,1'),(3,4)-butadiene-type 3-substituted Flavone	Dorsilurin E
[Isoflavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Isoflavone	Orobol 6-C-(6''-acetylglucoside)
[Isoflavone]-A(2OH, 1(1(O-Acetyl)-C-Glu))-B(2OH)	Isoflavone	Orobol 8-C-(6''-acetylglucoside)

Level: 3, プリカーサーm/z: 246.15227

Splash: splash10-000i-1900000000-fb3678afff8bfc3c6b78

m/z	Int.	NL	Rel.Int.
186.96	864	59	1000
84.79	185	161	213