MassBank Record: JP010519



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

ACCESSION: JP010519
RECORD_TITLE: XANTHENE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA

CH$NAME: XANTHENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C13H10O CH$EXACT_MASS: 182.07316 CH$SMILES: c(c3)cc(C1)c(c3)Oc(c2)c(ccc2)1 CH$IUPAC: InChI=1S/C13H10O/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12/h1-8H,9H2 CH$LINK: CAS 92-83-1 CH$LINK: INCHIKEY GJCOSYZMQJWQCA-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI M-80 AC$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$SPLASH: splash10-001i-0900000000-657d8c5027c1e05a2b14 PK$NUM_PEAK: 16 PK$PEAK: m/z int. rel.int. 28 1.59 16 39 0.9 9 63 1.47 15 76 1.84 18 77 1.01 10 91 1.25 13 126 1.03 10 127 1.53 15 151 2.52 25 152 10.02 100 153 2.8 28 180 1.04 10 181 99.99 999 182 61.3 613 183 8.25 83 184 1.27 13 //