MassBank Record: JP006886


 HEPTADECANE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n 
ACCESSION: JP006886
RECORD_TITLE: HEPTADECANE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: TAJIMA SGUNMA COLLEGE OF TECHNOLOGY, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: HEPTADECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C17H36
CH$EXACT_MASS: 240.28170
CH$SMILES: CCCCCCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3
CH$LINK: INCHIKEY NDJKXXJCMXVBJW-UHFFFAOYSA-N

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-052f-9000000000-4a1e4072537ab44135b1
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
  27 9.28 93
  29 25.39 254
  39 5.37 54
  41 41.91 419
  42 10.99 110
  43 88.81 888
  44 2.96 30
  53 2.08 21
  54 2.55 26
  55 22.73 227
  56 14.91 149
  57 99.99 999
  58 4.2 42
  67 1.6 16
  68 1.37 14
  69 9.52 95
  70 10.37 104
  71 58.65 587
  72 2.91 29
  82 1.36 14
  83 5.28 53
  84 5.59 56
  85 36.02 360
  86 1.65 17
  97 2.82 28
  98 3.99 40
  99 8.93 89
  112 2.85 29
  113 4.83 48
  126 2.22 22
  127 3.56 36
  140 1.41 14
  141 3.03 30
  155 1.49 15
  169 1.57 16
  183 1.28 13
  240 2.73 27
//