ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009302
RECORD_TITLE: BUTANE (1-D1); 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$NAME: BUTANE (1-D1)
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₁₀
CH$EXACT_MASS: 58.07825
CH$SMILES: CCCC([2H])([H])[2H]
CH$IUPAC: InChI=1S/C4H10/c1-3-4-2/h3-4H2,1-2H3/i1D2
CH$LINK: INCHIKEY IJDNQMDRQITEOD-DICFDUPASA-N

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 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0006-9000000000-d431e923e728d9836ccd
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
  27 5.1 51
  28 15.5 155
  29 25.6 256
  30 1.3 13
  41 11.4 114
  42 16.3 163
  43 21.3 213
  44 99.99 999
  45 3 30
  56 3.9 39
  58 3.2 32
  59 17.6 176
//