MassBank Record: PB002404



 Naringenin; LC-ESI-QTOF; MS2; CE:55 eV; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: PB002404
RECORD_TITLE: Naringenin; LC-ESI-QTOF; MS2; CE:55 eV; [M-H]-
DATE: 2016.01.19 (Created 2008.01.02, modified 2013.06.04)
AUTHORS: Boettcher C, Institute of Plant Biochemistry, Halle, Germany
LICENSE: CC BY-SA
COMMENT: IPB_RECORD: 1741
COMMENT: CONFIDENCE: confident structure

CH$NAME: Naringenin CH$NAME: 5,7-dihydroxy-2-(4-hydroxyphenyl)chroman-4-one CH$COMPOUND_CLASS: Natural Product; Flavanone CH$FORMULA: C15H12O5 CH$EXACT_MASS: 272.06847 CH$SMILES: C1C(OC2=CC(=CC(=C2C1=O)O)O)C3=CC=C(C=C3)O CH$IUPAC: InChI=1S/C15H12O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-6,13,16-18H,7H2 CH$LINK: INCHIKEY FTVWIRXFELQLPI-UHFFFAOYSA-N CH$LINK: KEGG C00509 CH$LINK: PUBCHEM CID:932
AC$INSTRUMENT: API QSTAR Pulsar i AC$INSTRUMENT_TYPE: LC-ESI-QTOF AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 55 eV AC$MASS_SPECTROMETRY: IONIZATION ESI
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-014i-6900000000-300152f0ae1c29f00dca PK$NUM_PEAK: 13 PK$PEAK: m/z int. rel.int. 63.025 2982.475 297 65.004 4591.658 458 68.999 192.674 18 83.012 932.001 92 93.035 1002.804 99 107.016 751.840 74 108.024 133.544 12 115.057 107.150 9 117.035 968.805 95 119.050 10000.000 999 143.053 249.106 23 145.031 248.966 23 187.037 121.381 11 //