ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001810
RECORD_TITLE: 1,2-DIHYDROXYLBUTANE; 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$NAME: 1,2-DIHYDROXYLBUTANE
CH$NAME: 1,2-BUTANEDIOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₁₀O₂
CH$EXACT_MASS: 90.06808
CH$SMILES: CCC(O)CO
CH$IUPAC: InChI=1S/C4H10O2/c1-2-4(6)3-5/h4-6H,2-3H2,1H3
CH$LINK: COMPTOX DTXSID6040375
CH$LINK: INCHIKEY BMRWNKZVCUKKSR-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:11429

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$SPLASH: splash10-0a59-9000000000-2535214e40df35508a77
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  15 4.46 45
  18 1.28 13
  19 1 10
  26 1.15 12
  27 7.72 77
  28 2.23 22
  29 9.69 97
  30 1 10
  31 61.42 614
  32 1.02 10
  33 1.08 11
  39 4.15 42
  41 27.17 272
  42 3.25 33
  43 20.41 204
  44 2.1 21
  45 1.21 12
  55 3.64 36
  57 4.78 48
  58 9.76 98
  59 99.99 999
  60 3.89 39
  61 20.41 204
  73 1.47 15
//