ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005857
RECORD_TITLE: PROPARGYL ALCOHOL; 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$NAME: PROPARGYL ALCOHOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₃H₄O
CH$EXACT_MASS: 56.02621
CH$SMILES: C#CCO
CH$IUPAC: InChI=1S/C3H4O/c1-2-3-4/h1,4H,3H2
CH$LINK: INCHIKEY TVDSBUOJIPERQY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5021883

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$SPLASH: splash10-0a4i-9000000000-daffa67539f7b0864af6
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  24 1.64 16
  25 4.74 47
  26 8.21 82
  27 16.61 166
  28 18.43 184
  29 14.78 148
  30 2.37 24
  31 1.82 18
  36 2.19 22
  37 8.21 82
  38 11.68 117
  39 24.45 245
  40 1.09 11
  52 1.09 11
  53 7.48 75
  54 1.64 16
  55 99.99 999
  56 3.47 35
//