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ACCESSION
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Petunidin 3-O-(6-O-p-coumaroyl)glucoside; MS2; QqQ; M+; n.d.
2009.1.6 Copyright(C) 2013 Center for Sustainable Resource Science, RIKEN
Record Data
Tag | Sub Tag | Data |
---|---|---|
ACCESSION | PM015362 | |
RECORD_TITLE | Petunidin 3-O-(6-O-p-coumaroyl)glucoside; MS2; QqQ; M+; n.d. | |
DATE | 2009.1.6 | |
PUBLICATION | Tourino S, Fuguet E, Jauregui O, Saura-Calixto F, Cascante M, Torres JL.;Rapid Communications in Mass Spectrometry;2008 Nov;22(22):3489-500. | |
PUBLICATION | PUBMED |
18853405
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AUTHORS | Tourino S, 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 | Petunidin 3-O-(6-O-p-coumaroyl)glucoside | |
CH$ COMPOUND_CLASS | Flavonoid | |
CH$ COMPOUND_CLASS | Anthocyanin | |
CH$ COMPOUND_CLASS | Petunidin glycoside | |
CH$ LINK | CAS | N/A |
CH$ FORMULA | C31H29O14 | |
CH$ EXACT_MASS | 625.16 | |
CH$ SMILES | N/A | |
CH$ INCHI | N/A | |
AC$ ANALYTICAL_CONDITION | SOLVENT | H2O/CH3CN/HCOOH |
AC$ ANALYTICAL_CONDITION | MS_TYPE | QqQ |
AC$ ANALYTICAL_CONDITION | MODEL | API 3000 |
AC$ ANALYTICAL_CONDITION | COLLISION_ENERGY | n.d. |
AC$ ANALYTICAL_CONDITION | IONIZATION | ESI |
AC$ ANALYTICAL_CONDITION | MODE | positive |
SP$ SAMPLE | Vitis vinifera | |
MS$ FOCUSED_ION | ION_TYPE | M+ |
MS$ FOCUSED_ION | PRECURSOR_M/Z | 625 |
PK$ NUM_PEAK | 2 | |
PK$ PEAK |
m/z int. rel.int. ![]() ![]() ![]()
625
0
50
317
0
100
|