MassBank Record: JP001635



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

ACCESSION: JP001635
RECORD_TITLE: ISOQUINOLINE; 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$NAME: ISOQUINOLINE CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H7N CH$EXACT_MASS: 129.05785 CH$SMILES: c(c2)cc(c1)c(c2)cnc1 CH$IUPAC: InChI=1S/C9H7N/c1-2-4-9-7-10-6-5-8(9)3-1/h1-7H CH$LINK: CAS 119-65-3
AC$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: splash10-0fb9-9700000000-153cb7989d20a5d305fe PK$NUM_PEAK: 36 PK$PEAK: m/z int. rel.int. 32 5.62 56 37 3.36 34 38 6.35 64 39 10.45 105 40 1.12 11 43 1.51 15 44 2.93 29 49 4.31 43 50 25.88 259 51 52.69 527 52 9.47 95 53 1.07 11 61 2.78 28 62 5.31 53 63 10.09 101 64 6.93 69 65 2.24 22 73 1.71 17 74 12.14 121 75 18.81 188 76 21.16 212 77 9.52 95 78 6.63 66 79 1.23 12 87 1.23 12 89 1.45 15 98 1.56 16 99 1.14 11 100 1.71 17 101 11.34 113 102 45.84 458 103 11.56 116 127 1.23 12 128 20.14 201 129 99.99 999 130 10.51 105 //