ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009708
RECORD_TITLE: PENTAMETHYLBENZENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: PENTAMETHYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₆
CH$EXACT_MASS: 148.12520
CH$SMILES: Cc(c1)c(C)c(C)c(C)c(C)1
CH$IUPAC: InChI=1S/C11H16/c1-7-6-8(2)10(4)11(5)9(7)3/h6H,1-5H3
CH$LINK: INCHIKEY BEZDDPMMPIDMGJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6061024

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-001j-0900000000-e7214fbacb15abbbb8db
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  41 1.15 12
  91 3.09 31
  105 3.56 36
  117 2.51 25
  118 1.21 12
  119 1.74 17
  131 1.67 17
  132 1 10
  133 99.99 999
  134 11.19 112
  147 6.77 68
  148 76.54 765
  149 9.05 91
//