ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007111
RECORD_TITLE: SEC-BUTYL ALCOHOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: SEC-BUTYL ALCOHOL
CH$NAME: 2-BUTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₄H₁₀O
CH$EXACT_MASS: 74.07316
CH$SMILES: CCC(C)O
CH$IUPAC: InChI=1S/C4H10O/c1-3-4(2)5/h4-5H,3H2,1-2H3
CH$LINK: CAS 78-92-2
CH$LINK: INCHIKEY BTANRVKWQNVYAZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9021762

AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0002-9000000000-ef7cd62aa636fe20c0eb
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
  15 2.66 27
  19 2.04 20
  26 2.33 23
  27 13.12 131
  29 10.92 109
  31 16.62 166
  39 3.37 34
  41 10.46 105
  42 1.41 14
  43 10.62 106
  44 8.44 84
  45 99.99 999
  46 2.26 23
  55 2.16 22
  57 2.75 28
  59 21.81 218
  73 1.17 12
//