ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008145
RECORD_TITLE: TRICOSANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAOKA R, KYOTO INSTITUTE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: TRICOSANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₂₃H₄₈
CH$EXACT_MASS: 324.37560
CH$SMILES: CCCCCCCCCCCCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C23H48/c1-3-5-7-9-11-13-15-17-19-21-23-22-20-18-16-14-12-10-8-6-4-2/h3-23H2,1-2H3
CH$LINK: INCHIKEY FIGVVZUWCLSUEI-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7047699

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$SPLASH: splash10-052f-9000000000-57d59760fb19a88b8aae
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
  41 38.68 387
  42 19.82 198
  43 84.79 848
  45 1.2 12
  56 19.63 196
  57 99.99 999
  58 8.64 86
  68 3.11 31
  70 8.56 86
  71 70.71 707
  72 3.63 36
  82 2.16 22
  83 1.17 12
  84 6.83 68
  85 46.96 470
  86 2.48 25
  99 11.83 118
  112 1.61 16
  113 9.27 93
  127 5.05 51
  131 1.8 18
  135 1.61 16
  140 2.69 27
  141 4.22 42
  155 3.2 32
  168 2.13 21
  183 3.25 33
  197 1.84 18
  207 5.01 50
  211 1.65 17
  224 1.62 16
  225 1.15 12
  253 1.38 14
  324 2.91 29
//