ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012164
RECORD_TITLE: PENTADECANE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: IIDA Y, DAISHIMA S, FAC. OF ENGINEERING, SEIKEI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: PENTADECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₃₂
CH$EXACT_MASS: 212.25040
CH$SMILES: CCCCCCCCCCCCCCC
CH$IUPAC: InChI=1S/C15H32/c1-3-5-7-9-11-13-15-14-12-10-8-6-4-2/h3-15H2,1-2H3
CH$LINK: CAS 629-62-9
CH$LINK: INCHIKEY YCOZIPAWZNQLMR-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6027268

AC$INSTRUMENT: FINNIGAN-MAT 4500
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 120 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE

PK$SPLASH: splash10-03di-7390000000-f509a4515ba26bf8afce
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  55 5.59 56
  56 3.93 39
  57 30.19 302
  58 1.39 14
  59 1.75 18
  69 1.86 19
  71 38.75 388
  72 2.9 29
  85 8.92 89
  99 6.81 68
  113 6.88 69
  127 6.24 62
  141 5.48 55
  155 4.15 42
  169 2.78 28
  183 2.86 29
  197 10 100
  198 1.59 16
  211 99.99 999
  212 17.78 178
  213 1.55 16
//