ピーク情報

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pos

Peak #10119 MN MID: SE205_S02_M90

m/z: 545.38432, RT: 90.14, 強度: 135745, ログ強度: 1.61, アダクト: [M+CH3OH-H2O+H]+, 共有数（同様のピークを含むサンプル数）: 3

DB検索結果: (9 names) Phyllofenone C;(+)-Phyllofenone C;Holstinone A;(-)-Holstinone A;Rubianol b;Cordianol F;(+)-Cordianol F;Acinospesigenin A;Guavanoic acid

DBごとのヒット数: ALL 6 KN 6

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
C32H50O6	530.36074	1.242	Phyllofenone C	KNApSAcK: C00046855
C32H50O6	530.36074	1.242	(22E,24R)-25-hydroxy-3,3-dimethoxy-11alpha-acetoxyergosta-7,22-diene-6-one	LipidMAPS: LMST01031341
C32H50O6	530.36074	1.242	Holstinone A	KNApSAcK: C00039378
C32H50O6	530.36074	1.242	7beta-acetoxy-3beta,24S-dihydroxy-9beta,19-cyclolanost-25-en-28-oic acid	LipidMAPS: LMST01100056
C32H50O6	530.36074	1.242	Rubianol b	KNApSAcK: C00031235
C32H50O6	530.36074	1.242	Cordianol F	KNApSAcK: C00044654
C32H50O6	530.36074	1.242	Acinospesigenin A	KNApSAcK: C00044493 LipidMAPS: LMPR0106160001
C32H50O6	530.36074	1.242	Guavanoic acid	KNApSAcK: C00037224
C32H50O6	530.36074	1.242	7beta-acetoxy,3beta,25-dihydroxy-9beta,19-cyclo-lanost-23E-en-28-oic acid	LipidMAPS: LMST01100055

MSnスペクトル情報

Level: 2, プリカーサーm/z: 545.38318

Splash: splash10-004i-0120290000-2d07efc81a30ddbf893b

m/z	Int.	NL	Rel.Int.
527.42	22593	18	1000
211.07	5749	334	254
193.14	3855	352	170
453.51	3265	92	144
471.53	2427	74	107
435.46	2141	110	94
509.49	2050	36	90
267.26	1931	278	85
335.32	1392	210	61
175.11	1300	370	57

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[2'-Hydroxychalcone]-A(2OH, 1Geranyl)-B(2OH, 1Geranyl)	2'-Hydroxychalcone	Prorepensin

Level: 3, プリカーサーm/z: 211.13542

Splash: splash10-0006-0900000000-fda39b7bd52f8790312f

m/z	Int.	NL	Rel.Int.
193.04	1809	18	1000
175.13	206	36	113
110.94	96	100	53

Score	Symbolized Name	MSMS-Category	MSMS-Aglycone
0.000	[Dihydrochalcone]-A(none)-B(none)	Dihydrochalcone	Dihydrochalcone

Level: 3, プリカーサーm/z: 527.40875

Splash: splash10-0zmi-0002910000-f45c4afb03e895745e89

m/z	Int.	NL	Rel.Int.
471.42	1524	56	1000
453.36	1070	74	702
509.43	909	18	596
435.42	797	92	523
301.26	717	226	470
417.39	321	110	210
491.46	275	36	180
473.41	261	54	171
357.25	151	170	98
199.22	149	328	97
171.05	118	356	77
341.33	113	186	74
423.19	112	104	73
183.25	108	344	71
285.32	104	242	68
197.24	101	330	66
263.03	98	264	64
337.24	97	190	63
401.49	86	126	56
403.41	83	124	54

Symbolized Name	MSMS-Category	MSMS-Aglycone
[2'-Hydroxychalcone]-A(2OH, 1([3,2:@@]-(5-oxo-11-Hydroxy-11-styryl-4,10-dioxa-bicyclo[7.3.1]-2-trideceno)))-B(none)	2'-Hydroxychalcone	Kurzichalcolactone
[Flavanone]-A(1OH, 1([3,2:@@]-(5-oxo-11-Hydroxy-11-styryl-4,10-dioxa-bicyclo[7.3.1]-2-trideceno)))-B(none)	Flavanone	Kurziflavolactone A
[Flavanone]-A(1OH, 1([3,2:@@]-(5-oxo-11-Hydroxy-11-styryl-4,10-dioxa-bicyclo[7.3.1]-2-trideceno)))-B(none)	Flavanone	Kurziflavolactone C
[Dihydroflavonol]-A(2OH, 1(3-Hydroxy-3-methylbutyl), 1Lavandulyl)-B(2OH)	Dihydroflavonol	Kosamol A
[Flavan 3-ol]-A(2OH, 1(2,4,6-Trihydroxy-3-isobutyryl-5-methylbenzyl))-B(2OH)	Flavan 3-ol	Pilosanol B
[Flavan 3-ol]-A(2OH, 1(3-Butyryl-2,4,6-trihydroxy-5-methylbenzyl))-B(2OH)	Flavan 3-ol	Pilosanol C

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