Prunin; MS2; QqQ; M-H; -20

2006.4.20 Copyright(C) 2013 Center for Sustainable Resource Science, RIKEN

Record Data

Tag Sub Tag Data
ACCESSION PM000414
RECORD_TITLE Prunin; MS2; QqQ; M-H; -20
DATE 2006.4.20
PUBLICATION Sanchez-Rabaneda F, Jauregui O, Casals I, Andres-Lacueva C, Izquierdo-Pulido M, Lamuela-Raventos RM.;Journal of Mass Spectrometry;2003 Jan;38(1):35-42.
PUBLICATION PUBMED 12526004 LinkIcon
AUTHORS Sanchez-Rabaneda F, et al.
COMMENTS N/A
COMMENTS 726
COPYRIGHT Copyright(C) 2013 Center for Sustainable Resource Science, RIKEN
STRUCTURE_FILE_NAME N/A
CH$ NAME Prunin
CH$ COMPOUND_CLASS Flavonoid
CH$ COMPOUND_CLASS Chalcone
CH$ COMPOUND_CLASS Naringenin glycoside
CH$ LINK CAS 529-55-5
CH$ FORMULA C21H22O10
CH$ EXACT_MASS 434.12
CH$ SMILES N/A
CH$ INCHI N/A
AC$ ANALYTICAL_CONDITION SOLVENT H2O/NH3CN/HCOOH
AC$ ANALYTICAL_CONDITION MS_TYPE QqQ
AC$ ANALYTICAL_CONDITION MODEL API 3000
AC$ ANALYTICAL_CONDITION COLLISION_ENERGY -20
AC$ ANALYTICAL_CONDITION IONIZATION ESI
AC$ ANALYTICAL_CONDITION MODE negative
SP$ SAMPLE Theobroma cacao
MS$ FOCUSED_ION ION_TYPE M-H
MS$ FOCUSED_ION PRECURSOR_M/Z 433
PK$ NUM_PEAK 2
PK$ PEAK m/z int. rel.int.
[-] m/z
[-] Intensity
[-] Relative intensity
433
0
70
271
0
100

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