ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001477
RECORD_TITLE: BUTYRALDEHYDE; 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$NAME: BUTYRALDEHYDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₈O
CH$EXACT_MASS: 72.05751
CH$SMILES: CCCC=O
CH$IUPAC: InChI=1S/C4H8O/c1-2-3-4-5/h4H,2-3H2,1H3
CH$LINK: INCHIKEY ZTQSAGDEMFDKMZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8021513

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$SPLASH: splash10-002f-9000000000-98b59bf5bd3eda9e49fa
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
  14 3.32 33
  15 12.25 123
  25 1.5 15
  26 12.42 124
  27 92.63 926
  28 24.37 244
  29 64.18 642
  30 1.89 19
  31 3 30
  37 4.3 43
  38 7.56 76
  39 36.49 365
  40 4.89 49
  41 74.33 743
  42 10.62 106
  43 77.72 777
  44 99.99 999
  45 3.45 35
  50 1.96 20
  51 1.11 11
  53 1.43 14
  54 2.41 24
  55 1.76 18
  57 25.34 253
  58 1.05 11
  71 6.13 61
  72 58.51 585
  73 3.39 34
//