MassBank Record: JP001133



 UMBELLIFERONE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001133
RECORD_TITLE: UMBELLIFERONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NAKAYAMA M, MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: UMBELLIFERONE CH$NAME: 7-HYDROXYCOUMARIN CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H6O3 CH$EXACT_MASS: 162.03169 CH$SMILES: O=C(C=2)Oc(c1)c(C2)ccc(O)1 CH$IUPAC: InChI=1S/C9H6O3/c10-7-3-1-6-2-4-9(11)12-8(6)5-7/h1-5,10H
AC$INSTRUMENT: HITACHI RMU-7L AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-03gi-9700000000-61b0cf13acd34fc7ef62 PK$NUM_PEAK: 38 PK$PEAK: m/z int. rel.int. 17 1.3 13 18 3.8 38 27 5.1 51 28 9.1 91 29 3.8 38 31 1.3 13 37 2.6 26 38 14.1 141 39 14.1 141 41 2.6 26 42 2.6 26 49 2.6 26 50 14.1 141 51 33.3 333 52 14.1 141 53 6.4 64 55 3.8 38 61 5.1 51 62 12.8 128 63 20.5 205 64 3.8 38 65 10.3 103 66 1.3 13 67 25.6 256 74 1.3 13 77 23.1 231 78 42.3 423 79 1.3 13 80 1.3 13 87 1.3 13 105 28.2 282 106 7.7 77 108 1.3 13 133 3.8 38 134 91 910 135 6.4 64 162 99.99 999 163 6.4 64 //