trans-Resveratrol; MS2; QIT; M+H; 100%

2008.3.6 Copyright(C) 2013 Center for Sustainable Resource Science, RIKEN

Record Data

Tag Sub Tag Data
ACCESSION PM003720
RECORD_TITLE trans-Resveratrol; MS2; QIT; M+H; 100%
DATE 2008.3.6
PUBLICATION Pussa T, Floren J, Kuldkepp P, Raal A.;Journal of Agricultural and Food Chemistry;2006 Oct 4;54(20):7488-94.
PUBLICATION PUBMED 17002412 LinkIcon
AUTHORS Pussa T, Floren J, Kuldkepp P, & Raal A
COMMENTS N/A
COMMENTS N/D
COPYRIGHT Copyright(C) 2013 Center for Sustainable Resource Science, RIKEN
STRUCTURE_FILE_NAME N/A
CH$ NAME trans-Resveratrol
CH$ COMPOUND_CLASS Stilbenoid
CH$ COMPOUND_CLASS Resveratrol
CH$ LINK CAS 20315-25-7
CH$ FORMULA C30H26O12
CH$ EXACT_MASS 578.14
CH$ SMILES N/A
CH$ INCHI N/A
AC$ ANALYTICAL_CONDITION SOLVENT H2O/CH3CN/HCOOH
AC$ ANALYTICAL_CONDITION MS_TYPE QIT
AC$ ANALYTICAL_CONDITION MODEL XCT
AC$ ANALYTICAL_CONDITION COLLISION_ENERGY 100%
AC$ ANALYTICAL_CONDITION IONIZATION ESI
AC$ ANALYTICAL_CONDITION MODE positive
SP$ SAMPLE Vitis vinifera
MS$ FOCUSED_ION ION_TYPE M+H
MS$ FOCUSED_ION PRECURSOR_M/Z 579
PK$ NUM_PEAK 7
PK$ PEAK m/z int. rel.int.
[-] m/z
[-] Intensity
[-] Relative intensity
427
0
100
409
0
29
291
0
21
301
0
14
247
0
10
289
0
8
287
0
8

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