MassBank Record: PB002403



 Naringenin; LC-ESI-QTOF; MS2; CE:40 eV; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: PB002403
RECORD_TITLE: Naringenin; LC-ESI-QTOF; MS2; CE:40 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$MASS_SPECTROMETRY: COLLISION_ENERGY 40 eV AC$MASS_SPECTROMETRY: IONIZATION ESI
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-014i-2900000000-4b44af7541ec3e49a2fa PK$NUM_PEAK: 17 PK$PEAK: m/z int. rel.int. 63.025 1516.982 150 65.004 1868.391 185 83.013 999.035 98 93.034 737.553 72 107.016 3164.801 315 108.024 129.101 11 117.036 230.027 22 119.050 10000.000 999 121.029 140.544 13 143.052 283.288 27 145.031 275.762 26 151.004 2111.154 210 161.062 317.445 30 165.020 201.081 19 177.017 313.971 30 185.058 182.999 17 187.037 613.277 60 //