MassBank Record: JP000789



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

ACCESSION: JP000789
RECORD_TITLE: PHENANTHRIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: PHENANTHRIDINE CH$COMPOUND_CLASS: N/A CH$FORMULA: C13H9N CH$EXACT_MASS: 179.07350 CH$SMILES: c(c3)cc(c1)c(c3)c(c2)c(ccc2)n1 CH$IUPAC: InChI=1S/C13H9N/c1-2-6-11-10(5-1)9-14-13-8-4-3-7-12(11)13/h1-9H
AC$INSTRUMENT: VARIAN MAT-44S AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 75 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-004i-3900000000-9e822de9fe24cc4297f7 PK$NUM_PEAK: 37 PK$PEAK: m/z int. rel.int. 40 2.4 24 50 5.44 54 51 5.54 55 52 1.71 17 61 1.62 16 62 4.65 47 63 12.49 125 74 5.29 53 75 11.56 116 76 20.28 203 77 1.81 18 86 1.86 19 87 2.79 28 88 1.62 16 89 6.03 60 98 2.01 20 99 2.45 25 100 1.57 16 101 1.57 16 102 1.67 17 113 1.27 13 125 2.45 25 126 4.16 42 127 1.81 18 128 1.13 11 140 1.08 11 149 1.57 16 150 8.87 89 151 17.2 172 152 12.59 126 153 6.03 60 176 1.81 18 177 7.59 76 178 23.96 240 179 99.99 999 180 16.02 160 181 1.37 14 //