ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005995
RECORD_TITLE: METHYLCYCLOPENTANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: METHYLCYCLOPENTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₂
CH$EXACT_MASS: 84.09390
CH$SMILES: CC(C1)CCC1
CH$IUPAC: InChI=1S/C6H12/c1-6-4-2-3-5-6/h6H,2-5H2,1H3
CH$LINK: INCHIKEY GDOPTJXRTPNYNR-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3025590

AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-0a4l-9000000000-f36947d92a09565016ad
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
  15 1 10
  17 1.9 19
  18 8.7 87
  26 0.14 1
  27 12.5 125
  28 5.7 57
  29 7.5 75
  32 0.07 1
  37 0.6 6
  38 1.4 14
  39 15.6 156
  40 0.37 4
  41 51.4 514
  42 24 240
  43 10.5 105
  50 0.11 1
  51 1.8 18
  52 0.7 7
  53 3.4 34
  54 0.3 3
  55 24.1 241
  56 99.99 999
  57 4.8 48
  65 0.08 1
  66 0.6 6
  67 2.6 26
  68 4.1 41
  69 3.72 37
  70 2.2 22
  83 1 10
  84 25.5 255
  85 1.8 18
//