ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005673
RECORD_TITLE: 2-METHYL-2-BUTANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA
CH$NAME: 2-METHYL-2-BUTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H12O
CH$EXACT_MASS: 88.08882
CH$SMILES: CCC(C)(C)O
CH$IUPAC: InChI=1S/C5H12O/c1-4-5(2,3)6/h6H,4H2,1-3H3
CH$LINK: INCHIKEY MSXVEPNJUHWQHW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0041436
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0ab9-9000000000-0baeab474747cad02981
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  27 1.95 20
  29 4.72 47
  31 14.82 148
  39 1.48 15
  41 9.12 91
  42 1.15 12
  43 19.52 195
  45 8.84 88
  55 27.83 278
  56 1.43 14
  57 1.26 13
  58 1.29 13
  59 99.99 999
  60 3.63 36
  70 1.2 12
  71 13.5 135
  73 70.2 702
  74 3.19 32
  87 0.18 2
  88 0.02 0
//
