Dimethyl lithospermate; MS2; QIT; M-H; 20->50%

2008.12.15 Copyright(C) 2013 Center for Sustainable Resource Science, RIKEN

Record Data

Tag Sub Tag Data
ACCESSION PM014504
RECORD_TITLE Dimethyl lithospermate; MS2; QIT; M-H; 20->50%
DATE 2008.12.15
PUBLICATION Zhu Z, Zhang H, Zhao L, Dong X, Li X, Chai Y, Zhang G.;Rapid Communications in Mass Spectrometry;2008 Sep;22(18):2813-24.
PUBLICATION PUBMED 17510941 LinkIcon
AUTHORS Zhu Z, et al.
COMMENTS N/A
COMMENTS N/D
COPYRIGHT Copyright(C) 2013 Center for Sustainable Resource Science, RIKEN
STRUCTURE_FILE_NAME N/A
CH$ NAME Dimethyl lithospermate
CH$ COMPOUND_CLASS Other
CH$ COMPOUND_CLASS Other
CH$ COMPOUND_CLASS Other
CH$ LINK CAS 54844-34-7
CH$ FORMULA C29H26O12
CH$ EXACT_MASS 566.14
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 LCQ
AC$ ANALYTICAL_CONDITION COLLISION_ENERGY 20->50%
AC$ ANALYTICAL_CONDITION IONIZATION ESI
AC$ ANALYTICAL_CONDITION MODE negative
SP$ SAMPLE Salvia miltiorrhizae
MS$ FOCUSED_ION ION_TYPE M-H
MS$ FOCUSED_ION PRECURSOR_M/Z 565
PK$ NUM_PEAK 4
PK$ PEAK m/z int. rel.int.
[-] m/z
[-] Intensity
[-] Relative intensity
533
0
100
371
0
13
339
0
21
321
0
16

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