ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001549
RECORD_TITLE: CYCLOPENTANOL; 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$NAME: CYCLOPENTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₁₀O
CH$EXACT_MASS: 86.07316
CH$SMILES: OC(C1)CCC1
CH$IUPAC: InChI=1S/C5H10O/c6-5-3-1-2-4-5/h5-6H,1-4H2
CH$LINK: INCHIKEY XCIXKGXIYUWCLL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1033371

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$SPLASH: splash10-0a4i-9000000000-9389121d6ebc5c87496c
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  15 2.37 24
  26 2.37 24
  27 11.3 113
  28 5.46 55
  29 11.11 111
  30 3.21 32
  31 5.56 56
  38 1.64 16
  39 11.45 115
  40 3.96 40
  41 15.69 157
  42 4.36 44
  43 8.7 87
  44 34.84 348
  45 5.31 53
  51 1 10
  53 2.12 21
  55 2.55 26
  56 1.76 18
  57 99.99 999
  58 13.77 138
  67 5.87 59
  68 6.89 69
  69 2.09 21
  71 3.88 39
  85 1.02 10
  86 12.86 129
//