ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012305
RECORD_TITLE: 5-PHENYLDECANE; 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$NAME: 5-PHENYLDECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₂₆
CH$EXACT_MASS: 218.20345
CH$SMILES: CCCCCC(CCCC)c(c1)cccc1
CH$IUPAC: InChI=1S/C16H26/c1-3-5-8-12-15(11-6-4-2)16-13-9-7-10-14-16/h7,9-10,13-15H,3-6,8,11-12H2,1-2H3
CH$LINK: CAS 4537-11-5
CH$LINK: INCHIKEY CDOBABYRHNVZQG-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID90874873

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$SPLASH: splash10-0006-1930000000-3f5676cd63c5efbde6e1
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  57 3.2 32
  71 5.46 55
  85 6.26 63
  91 1.47 15
  99 3.5 35
  105 3.7 37
  107 2.07 21
  119 6.23 62
  133 5.08 51
  141 99.99 999
  142 11.19 112
  147 17.78 178
  148 2.35 24
  161 14.74 147
  162 2.08 21
  175 2.15 22
  189 2.09 21
  203 7.57 76
  204 1.25 13
  217 40.32 403
  218 12.12 121
  219 2.93 29
//