MassBank Record: JP001603



 2,3-BENZPHENANTHRENE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001603
RECORD_TITLE: 2,3-BENZPHENANTHRENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KOGA M, UNIV. OF OCCUPATIONAL AND ENVIRONMENTAL HEALTH
LICENSE: CC BY-NC-SA

CH$NAME: 2,3-BENZPHENANTHRENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C18H12 CH$EXACT_MASS: 228.09390 CH$SMILES: c(c4)cc(c3)c(c4)cc(c13)c(c2)c(ccc2)cc1 CH$IUPAC: InChI=1S/C18H12/c1-2-7-15-12-18-16(11-14(15)6-1)10-9-13-5-3-4-8-17(13)18/h1-12H CH$LINK: CAS 56-55-3
AC$INSTRUMENT: VARIAN MAT-44 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: splash10-01t9-1790000000-a4cb0dc693f64e392766 PK$NUM_PEAK: 26 PK$PEAK: m/z int. rel.int. 50 1.02 10 51 1.19 12 63 2.22 22 74 1.88 19 75 4.96 50 76 4.1 41 87 4.96 50 88 10.95 110 99 4.28 43 100 17.46 175 101 23.97 240 111 2.22 22 112 17.97 180 113 38.86 389 114 47.08 471 115 1.19 12 200 2.91 29 201 1.36 14 202 3.25 33 224 6.16 62 225 5.3 53 226 25.68 257 227 10.1 101 228 99.99 999 229 19.52 195 230 1.88 19 //