ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001654
RECORD_TITLE: ISOPROPYL ALCOHOL(2-D); EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: ISOPROPYL ALCOHOL(2-D)
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₃H₈O
CH$EXACT_MASS: 60.05751
CH$SMILES: [2H]C(C)(C)O
CH$IUPAC: InChI=1S/C3H8O/c1-3(2)4/h3-4H,1-2H3/i3D
CH$LINK: INCHIKEY KFZMGEQAYNKOFK-WFVSFCRTSA-N
CH$LINK: COMPTOX DTXSID70480714

AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-0002-9000000000-f68d78a99d0ee77081c8
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  15 2.52 25
  19 2.63 26
  20 2.09 21
  27 3.92 39
  28 8.05 81
  29 3.11 31
  30 2.52 25
  31 2.41 24
  32 1.07 11
  39 2.15 22
  40 1.72 17
  41 1.77 18
  42 4.03 40
  43 6.23 62
  44 7.14 71
  45 3.22 32
  46 99.99 999
  47 1.93 19
  59 1.56 16
//