ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007737
RECORD_TITLE: 2-BUTYRYLFURAN; 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$NAME: 2-BUTYRYLFURAN
CH$NAME: 1-(2-FURANYL)-1-BUTANONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10O2
CH$EXACT_MASS: 138.06808
CH$SMILES: CCCC(=O)c(o1)c([H])c([H])c([H])1
CH$IUPAC: InChI=1S/C8H10O2/c1-2-4-7(9)8-5-3-6-10-8/h3,5-6H,2,4H2,1H3
CH$LINK: CAS 4208-57-5
CH$LINK: INCHIKEY GONWJZJNVDRECJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID70863341
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$SPLASH: splash10-01ot-9400000000-f026e1f8c0834d5fe470
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  27 8.98 90
  29 2.1 21
  39 30.08 301
  40 2.78 28
  41 12.47 125
  42 10.63 106
  43 18.65 187
  53 3.92 39
  54 2.9 29
  55 8.48 85
  66 1.01 10
  67 6.56 66
  68 11.85 119
  69 2.31 23
  81 6.66 67
  82 2.02 20
  94 1 10
  95 99.99 999
  96 12.04 120
  97 1.95 20
  110 76.55 766
  111 9.54 95
  119 1.03 10
  123 22.42 224
  124 1.1 11
  125 1.75 18
  138 22.54 225
//
