ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007640
RECORD_TITLE: N-ISOBUTYLACETAMIDE; 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$NAME: N-ISOBUTYLACETAMIDE
CH$NAME: ACETYLAMINOISOBUTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₃NO
CH$EXACT_MASS: 115.09971
CH$SMILES: CC(C)CNC(C)=O
CH$IUPAC: InChI=1S/C6H13NO/c1-5(2)4-7-6(3)8/h5H,4H2,1-3H3,(H,7,8)
CH$LINK: CAS 1540-94-9
CH$LINK: INCHIKEY VDQMVRFHUYAKJL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID90165516

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 15 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-01x0-9200000000-2e8728f1f766083573c0
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  30 99.99 999
  31 2.83 28
  43 5.42 54
  45 2.4 24
  56 3.3 33
  57 1.56 16
  58 15.72 157
  60 52.16 522
  61 1.12 11
  72 54.73 547
  73 12.66 127
  74 1.73 17
  100 43.95 440
  101 2.83 28
  115 20.58 206
  116 8.76 88
//