ピーク情報

＜いも類＞（さつまいも類）さつまいも塊根皮むき生

pos

Peak #1718 MN MID: SE122_S020061_M90

m/z: 375.16491, RT: 43.04, 強度: 5853, ログ強度: 0.32, アダクト: [M+H]+, 共有数（同様のピークを含むサンプル数）: 7

DB検索結果: (3 names) (2E,4E)-8-(6-O-inositolyl)-8-oxo-2,7-dimethyl-octadienoic acid;Deoxyloganin;Dihydrosyringin

DBごとのヒット数: ALL 3 KG 1 KN 1 LM 1

FlavonoidSearch最大スコア MS2: 0.091, MS3: 0.125

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
C17H26O9	374.15768	-0.132	(2E,4E)-8-(6-O-inositolyl)-8-oxo-2,7-dimethyl-octadienoic acid	LipidMAPS: LMFA01020441
C17H26O9	374.15768	-0.132	Deoxyloganin	HMDB: HMDB0251007 KEGG: C06071, C11648 KNApSAcK: C00003077 LipidMAPS: LMPR0102070005, LMPR0102070020
C17H26O9	374.15768	-0.132	Dihydrosyringin	KNApSAcK: C00031751

MSnスペクトル情報

Level: 2, プリカーサーm/z: 375.16409

Splash: splash10-0a4i-0009000000-756cc0689528828b5026

m/z	Int.	NL	Rel.Int.
357.13	1125	18	1000
339.24	117	36	104
340.04	104	35	92
345.09	78	30	69
321.93	67	53	59
200.76	66	174	58

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.091	[Flavone]-A(1OH, 1OMe)-B(1OH, 3OMe)	Flavone	5,3'-Dihydroxy-7,2',4',5'-tetramethoxyflavone
0.091	[Flavone]-A(1OH, 1OMe)-B(1OH, 3OMe)	Flavone	5,4'-Dihydroxy-7,2',3',5'-tetramethoxyflavone
0.091	[Flavone]-A(2OH)-B(4OMe)	Flavone	5,7-Dihydroxy-2',3',4',5'-tetramethoxyflavone
0.091	[Flavone]-A(2OH, 1OMe)-B(3OMe)	Flavone	Arteanoflavone
0.091	[Flavone]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavone	5,4'-Dihidroxy-6,7,3',5'-tetramethoxyflavone
0.091	[Flavone]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavone	5,3'-Dihydroxy-6,7,4',5'-tetramethoxyflavone
0.091	[Flavone]-A(2OH, 1OMe)-B(3OMe)	Flavone	Tabularin
0.091	[Flavone]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavone	5,3'-Dihydroxy-7,8,4',5'-tetramethoxyflavone
0.091	[Flavone]-A(2OH, 1OMe)-B(3OMe)	Flavone	5,7-Dihydroxy-8,3',4',5'-tetramethoxyflavone
0.091	[Flavone]-A(1OH, 2OMe)-B(1OH, 2OMe)	Flavone	5,4'-Dihidroxy-7,8,2',3'-tetramethoxyflavone
0.091	[Flavone]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavone	Skullcapflavone II
0.091	[Flavone]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavone	8,3'-Dihydroxy-5,6,7,4'-tetramethoxyflavone
0.091	[Flavone]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavone	7-Methylsudachitin
0.091	[Flavone]-A(1OH, 3OMe)-B(1OH, 1OMe)	Flavone	Gardenin D
0.091	[Flavone]-A(2OH, 2OMe)-B(2OMe)	Flavone	Hymenoxin
0.091	[Flavone]-A(2OH, 2OMe)-B(2OMe)	Flavone	Pebrellin
0.083	[Isoflavone]-A(2OH, 1OMe)-B(3OMe)	Isoflavone	Junipegenin C
0.083	[Isoflavone]-A(2OH, 1OMe)-B(3OMe)	Isoflavone	Caviunin
0.083	[Isoflavone]-A(2OH, 1OMe)-B(3OMe)	Isoflavone	Isocaviunin
0.083	[Isoflavone]-A(1OH, 3OMe)-B(1OH, 1OMe)	Isoflavone	5,3'-Dihydroxy-6,7,8,2'-tetramethoxyisoflavone
0.071	[2'-Hydroxychalcone]-A(1OH, 3OMe)-B(2OMe)	2'-Hydroxychalcone	6'-Hydroxy-3,4,2',3',4'-pentamethoxychalcone
0.071	[2'-Hydroxychalcone]-A(1OH, 3OMe)-B(2OMe)	2'-Hydroxychalcone	2'-Hydroxy-3',4',6',3,4-pentamethoxychalcone
0.071	[2'-Hydroxychalcone]-A(1OH, 2OMe)-B(3OMe)	2'-Hydroxychalcone	2'-Hydroxy-3,4,5,4',6'-pentamethoxychalcone
0.071	[2'-Hydroxychalcone]-A(1OH, 2OMe)-B(3OMe)	2'-Hydroxychalcone	Rubone
0.063	[Flavanone]-A(4OMe)-B(1OMe)	Flavanone	5,6,7,8,4'-Pentamethoxyflavanone
0.063	[Flavanone]-A(3OMe)-B(2OMe)	Flavanone	5,6,7,3',4'-Pentamethoxyflavanone
0.063	[Flavanone]-A(2OMe)-B(3OMe)	Flavanone	5,7,2',3',4'-Pentamethoxyflavanone
0.000	[Flavonol]-A(1OH, 1OMe)-B(3OMe)	Flavonol	3,5-Dihydroxy-7,3',4',5'-tetramethoxyflavone
0.000	[Flavonol]-A(1OH, 3OMe)-B(1OMe)	Flavonol	Eriostemin
0.000	[Flavonol]-A(1OH, 3OMe)-B(1OMe)	Flavonol	3,5-Dihydroxy-6,7,8,4'-tetramethoxyflavone
0.000	[Flavonol]-A(1OH, 2OMe)-B(2OMe)	Flavonol	Quercetagetin 6,7,3'4'-tetramethyl ether
0.000	[Flavonol]-A(1OH, 2OMe)-B(2OMe)	Flavonol	Gossypetin 7,8,3',4'-tetramethyl ether
0.000	[Flavonol]-A(3OMe)-B(1OH, 1OMe)	Flavonol	Eupatoretin
0.000	[2'-Hydroxychalcone]-A(1OH, 1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	2'-Hydroxychalcone	Spinochalcone C
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(6-Methyl-6-(4-methyl-3-pentenyl)pyrano)))-B(none)	2'-Hydroxychalcone	Spinochalcone B
0.000	[Flavanone]-A(1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavanone	8-C-Prenyl-6'',6''-dimethylpyrano[2'',3'':7,6]flavanone
0.000	[Flavanone]-A(1(C-Prenyl), 1([2,3:@@]-(6,6-Dimethylpyrano)))-B(none)	Flavanone	Maximaflavanone A
0.000	[Flavanone]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(2OH)	Flavanone	6-C-(3-Hydroxyisopentyl)eriodictyol
0.000	[Dihydroflavonol]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(1OH)	Dihydroflavonol	8-(3-hydroxy-3-methylbutyl)aromadendrin
0.000	[Dihydroflavonol]-A(2OH, 1(3-hydroxy-3-methylbutyl))-B(1OH)	Dihydroflavonol	6-(3-Hydroxy-3-methylbutyl)aromadendrin
0.000	[Dihydroflavonol]-A(2OH, 1(3-Oxobutyl))-B(2OH)	Dihydroflavonol	6-(3''-Oxobutyl)taxifolin
0.000	[Dihydroflavonol]-A(1OH, 2OMe)-B(1OH)-C(1(O-Acetyl))	Dihydroflavonol	3,5,2'-Trihydroxy-7,8-dimethoxyflavanone 3-O-acetate
0.000	[Flavonol (3-OMe)]-A(2OH)-B(3OMe)	Flavonol	Myricetin 3,3',4',5'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	Myricetin 3,7,3',4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	5,5'-Dihydroxy-3,7,3',4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	Myricetin 3,7,3',5'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 2Methyl)-B(2OH, 1OMe)	Flavonol	6,8-Di-C-methylmyricetin 3,4'-dimethyl ether
0.000	[Flavonol (3-OMe)]-A(2OMe)-B(2OH, 1OMe)	Flavonol	5-O-Methyloxyayanin-A
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	Chrysosplenol G
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	Chrysosplenol E
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe)-B(1OH, 2OMe)	Flavonol	6,5'-Dihydroxy-3,7,2',4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Quercetagetin 3,5,6,3'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Quercetagetin 3,5,7,3'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Quercetagetin 3,5,7,4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OMe)	Flavonol	Bonanzin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Chrysosplenetin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Casticin
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OMe)	Flavonol	Quercetagetin 3,7,3',4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe, 1Methyl)-B(2OH)	Flavonol	8-C-Methylquercetagetin 3,6,7-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe, 1Methyl)-B(1OH, 1OMe)	Flavonol	8-C-Methylquercetagetin 3,6,3'-trimethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Chrysosplin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	5,5'-Dihydroxy-3,7,8,2'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Gossypetin 3,5,8,3'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OMe)	Flavonol	Gossypetin 3,7,3',4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Ternatin
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	Gossypetin 3,7,8,4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(2OH, 1OMe)-B(2OMe)	Flavonol	Gossypetin 3,8,3',4'-tetramethyl ether
0.000	[Flavonol (3-OMe)]-A(1OH, 2OMe)-B(1OH, 1OMe)	Flavonol	5,4'-Dihydroxy-3,7,8,2'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1OH)	Flavonol	7,4'-Dihydroxy-3,5,6,8-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OMe)	Flavonol	5,8-Dihydroxy-3,6,7,4'-tetramethoxyflavone
0.000	[Flavonol (3-OMe)]-A(1OH, 3OMe)-B(1OH)	Flavonol	Calycopterin
0.000	[Flavonol (3-OMe)]-A(2OH, 2OMe)-B(1OMe)	Flavonol	Araneosol
0.000	[Flavonol]-A(2OH, 2OMe)-B(1([@@]-Methylenedioxy))	Flavonol	Melinervin
0.000	[4-substituted Flavan (4-(4-Hydroxystyryl))]-A(1OMe)-B(1OH)	4-substituted Flavan	4'-Hydroxy-4-(4-hydroxystyryl)-7-methoxyflavan
0.000	[6-Hydroxyrotenone]-A(1OH, 1OMe)-B(2OMe)	6-Hydroxyrotenone	Dihydrostemonal

Level: 3, プリカーサーm/z: 357.12863

Splash: splash10-000i-0609000000-3d433100233a023f944b

m/z	Int.	NL	Rel.Int.
339.16	400	18	1000
165.05	203	192	506
182.93	92	174	229
311.17	45	46	111
285.24	41	72	101
137.08	34	220	84

FlavonoidSearch結果

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.125	[Dihydroflavonol]-A(2OH, 1(C-Prenyl))-B(1OH)	Dihydroflavonol	Shuterin
0.125	[Dihydroflavonol]-A(2OH, 1(C-Prenyl))-B(1OH)	Dihydroflavonol	8-prenylaromadendrin
0.125	[Dihydroflavonol]-A(2OH)-B(1OH, 1(C-Prenyl))	Dihydroflavonol	3'-prenylaromadendrin
0.111	[Flavanone]-A(2OH, 1(C-Prenyl))-B(2OH)	Flavanone	6-Prenyleriodictyol
0.111	[Flavanone]-A(2OH, 1(C-Prenyl))-B(2OH)	Flavanone	8-Prenyleriodictyol
0.111	[Flavanone]-A(2OH, 1(C-Prenyl))-B(2OH)	Flavanone	Leachianone G
0.111	[Isoflavanone]-A(2OH, 1(C-Prenyl))-B(2OH)	Isoflavanone	Kievitone
0.111	[Isoflavanone]-A(2OH, 1(C-Prenyl))-B(2OH)	Isoflavanone	Diphysolone
0.095	[2'-Hydroxychalcone]-A(2OH, 1(C-Prenyl))-B(3OH)	2'-Hydroxychalcone	Ramosismin
0.053	[Flavanone]-A(3OH)-B(1OH, 1(C-Prenyl))	Flavanone	Flowerone
0.053	[Flavanone]-A(2OH)-B(2OH, 1(C-Prenyl))	Flavanone	Sigmoidin B
0.053	[Flavanone]-A(2OH)-B(2OH, 1(C-Prenyl))	Flavanone	2'-Prenyleriodictyol
0.053	[Flavanone]-A(3OH, 1(C-Prenyl))-B(1OH)	Flavanone	8-Prenylcarthamidin
0.000	[2'-Hydroxychalcone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(1OH)	2'-Hydroxychalcone	Brosimacutin G
0.000	[Dihydrochalcone]-A(2OH, 1Methyl, 1([2,3:@@]-(4-hydroxy-6,6-Dimethyldihydropyrano)))-B(none)	Dihydrochalcone	2',4',4''-Trihydroxy-3',6'',6''-trimethylpyrano[2'',3'':6',5']dihydrochalcone
0.000	[Dihydrochalcone]-A(2OH, 1Methyl, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(none)	Dihydrochalcone	2',4',5''-Trihydroxy-3',6'',6''-trimethylpyrano[2'',3'':6',5']dihydrochalcone
0.000	[Dihydrochalcone]-A(2OH, 1OMe, 1(C-Prenyl))-B(1OH)	Dihydrochalcone	alpha,beta-Dihydroxanthohumol
0.000	[Dihydrochalcone]-A(3OH, 1OMe, 1(C-Prenyl))-B(none)	Dihydrochalcone	2',4',6'-Trihydroxy-3'-methoxy-5'-prenyldihydrochalcone
0.000	[Flavanone]-A(1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(2OH)	Flavanone	2',4'-Dihydroxy-2''-(1-hydroxy-1-methylethyl)dihydrofuro[2,3-h]flavanone
0.000	[Flavanone]-A(1OH, 1OMe, 1(3-hydroxy-3-methylbutyl))-B(none)	Flavanone	Tephrowatsin C
0.000	[Flavanone]-A(2OH, 1(2-hydroxy-3-methyl-3-butenyl))-B(1OH)	Flavanone	Tomentosanol D
0.000	[Flavanone]-A(2OH, 1((Z)-4-hydroxyprenyl))-B(1OH)	Flavanone	5,7,4'-Trihydroxy-8-C-(3-hydroxymethyl-2-butenyl)flavanone
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(5-(hydroxyisopropanyl)dihydrofurano)))-B(1OH)	Flavanone	Phellodensin D
0.000	[Flavanone]-A(2OH, 1(1,1-Dimethylallyl))-B(2OH)	Flavanone	6-(1,1-Dimethylallyl)eriodictyol
0.000	[Flavanone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(2OH)	Flavanone	Kenusanone J
0.000	[Flavone]-A(1OH, 1(2,3-Dihydroxy-3-methylbutyl))-B(1OH)	Flavone	Brosimacutin F
0.000	[Flavone]-A(1OH, 1([2,3:@@]-(6,6-Dimethyl-5-hydroxydihydropyrano)))-B(1OH)	Flavone	Laurifolin (flavonoid)
0.000	[Flavone]-A(2OH, 1(2-Carboxyvinyl))-B(2OH)	Flavone	Demethyltorosaflavone D
0.000	[Flavone]-A(2OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Flavone	5,7,3'-Trimethoxy-4',5'-methylenedioxyflavone
0.000	[Flavone]-A(3OMe)-B(1([@@]-Methylenedioxy))	Flavone	Ageconyflavone A
0.000	[Dihydroflavonol]-A(1OH, 1([2,3:@@]-(6,6-Dimethyldihydropyrano)))-B(1OH)	Dihydroflavonol	3,5,4'-Trihydroxy-4'',5''-dihydro-6'',6''-dimethylpyrano[2'',3'':7,8]flavanone
0.000	[Flavonol (3-OMe)]-A(1OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Flavonol	Kanugin
0.000	[Flavonol (3-OMe)]-A(1OH, 1OMe, 2Methyl)-B(1OMe)	Flavonol	Kalmiatin
0.000	[Flavonol (3-OMe)]-A(2OMe)-B(1([@@]-Methylenedioxy))	Flavonol	Isokanugin
0.000	[Flavan 3-ol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	Flavan 3-ol	8-Prenylafzelechin 5-methyl ether
0.000	[Flavan 4-ol]-A(1OH, 1OMe, 1(C-Prenyl))-B(1OH)	Flavan 4-ol	4,5,4'-Trihydroxy-7-methoxy-8-prenylflavan
0.000	[Flavan]-A(2OMe, 1(3-hydroxy-3-methylbutyl))-B(none)	Flavan	Nitenin
0.000	[Isoflavone]-A(2OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	6,7,3'-Trimethoxy-4',5'-methylenedioxyisoflavone
0.000	[Isoflavone]-A(2OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	Milldurone
0.000	[Isoflavone]-A(2OMe)-B(1OMe, 1([@@]-Methylenedioxy))	Isoflavone	7,8,2'-Trimethoxy-4',5'-methylenedioxyisoflavone
0.000	[Isoflavone]-A(3OMe)-B(1([@@]-Methylenedioxy))	Isoflavone	Petalostetin
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(2OMe)	Isoflavone	8,3',4'-Trimethoxy-6,7-methylenedioxyisoflavone
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(2OMe)	Isoflavone	Hemerocallone
0.000	[Isoflavone]-A(3OMe)-B(1([@@]-Methylenedioxy))	Isoflavone	Odoratine
0.000	[Isoflavone]-A(1OMe, 1([@@]-Methylenedioxy))-B(2OMe)	Isoflavone	Iriskumaonin methyl ether
0.000	[Isoflavanone]-A(1OH, 1((Z)-4-hydroxyprenyl))-B(2OH)	Isoflavanone	7,2',4'-Trihydroxy-8-((Z)-4-hydroxyprenyl)isoflavanone
0.000	[Isoflavan]-A(1OH)-B(2OH, 1OMe, 1(1,1-Dimethylallyl))	Isoflavan	alpha,alpha-dimethylallylcyclolobin
0.000	[Coumestan]-A(1OH, 2OMe)-B(1([@@]-Methylenedioxy))	Coumestan	2-Hydroxy-1,3-dimethoxy-8,9-methylenedioxycoumestan
0.000	[6-Hydroxydehydrorotenone]-A(3OH)-B(none)-C(1(O-Acetyl))	6-Hydroxydehydrorotenone	6,9,10,11-Tetrahydroxydehydrorotenone 6-O-acetate
0.000	[4-Hydroxy-3-phenylcoumarin (4-OMe)]-A(2OMe)-B(1([@@]-Methylenedioxy))	4-Hydroxy-3-phenylcoumarin	Derrusnin

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
	43.01	392.19143	17.0265	-0.09	[M+NH4]+	(3 names) (2E,4E)-8-(6-O-inositolyl)-8-oxo-2,7-dimethyl-octadienoic acid; Deoxyloganin; Dihydrosyringin	ALL 3 KG 1 KN 1 LM 1	MS2 MS3		0.133	1
1718	43.04	375.16491	0.0000	0.32	[M+H]+	(3 names) (2E,4E)-8-(6-O-inositolyl)-8-oxo-2,7-dimethyl-octadienoic acid; Deoxyloganin; Dihydrosyringin	ALL 3 KG 1 KN 1 LM 1	MS2 MS3	0.091	0.125	7
	43.03	357.15440	-18.0105	0.51	[M-H2O+H]+	(3 names) (2E,4E)-8-(6-O-inositolyl)-8-oxo-2,7-dimethyl-octadienoic acid; Deoxyloganin; Dihydrosyringin	ALL 3 KG 1 KN 1 LM 1	MS2 MS3 x 2	0.133		1

ピーク情報

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MSnスペクトル情報

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