Kaempferol sinapoyl triglucoside; MS2; QIT; M-H; 40V

2008.10.30 Copyright(C) 2013 Center for Sustainable Resource Science, RIKEN

Record Data

Tag Sub Tag Data
ACCESSION PM010118
RECORD_TITLE Kaempferol sinapoyl triglucoside; MS2; QIT; M-H; 40V
DATE 2008.10.30
PUBLICATION Harbaum B, Hubbermann EM, Zhu Z, Schwarz K.;Journal of Agricultural and Food Chemistry;2008 Jan 9;56(1):148-57. Epub 2007 Dec 14.
PUBLICATION PUBMED 18078315 LinkIcon
AUTHORS Harbaum B, Hubbermann EM, Zhu Z, & Schwarz K
COMMENTS N/A
COMMENTS N/D
COPYRIGHT Copyright(C) 2013 Center for Sustainable Resource Science, RIKEN
STRUCTURE_FILE_NAME N/A
CH$ NAME Kaempferol sinapoyl triglucoside
CH$ COMPOUND_CLASS Flavonoid
CH$ COMPOUND_CLASS Flavonol
CH$ COMPOUND_CLASS Kaempferol glycoside
CH$ LINK CAS N/A
CH$ FORMULA C44H50O25
CH$ EXACT_MASS 978.26
CH$ SMILES N/A
CH$ INCHI N/A
AC$ ANALYTICAL_CONDITION SOLVENT H2O/CH3CN/CF3COOH
AC$ ANALYTICAL_CONDITION MS_TYPE QIT
AC$ ANALYTICAL_CONDITION MODEL LC/MSD trap
AC$ ANALYTICAL_CONDITION COLLISION_ENERGY 40V
AC$ ANALYTICAL_CONDITION IONIZATION ESI
AC$ ANALYTICAL_CONDITION MODE negative
SP$ SAMPLE Brassica campestris L. ssp. chinensis var. communis
MS$ FOCUSED_ION ION_TYPE M-H
MS$ FOCUSED_ION PRECURSOR_M/Z 977
PK$ NUM_PEAK 6
PK$ PEAK m/z int. rel.int.
[-] m/z
[-] Intensity
[-] Relative intensity
785
0
16
771
0
100
753
0
15
609
0
2
591
0
1
429
0
2

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