ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000313
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$NAME: N-ISOBUTYLACETAMIDE
CH$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$LINK: INCHIKEY VDQMVRFHUYAKJL-UHFFFAOYSA-N
CH$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 80 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-001i-9000000000-62b4af452f097c8a0e2a
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  15 4.4 44
  27 3.6 36
  28 4.4 44
  29 0.32 3
  30 99.99 999
  31 3.4 34
  39 3.1 31
  41 0.67 7
  42 1.8 18
  43 27 270
  45 1.2 12
  55 0.17 2
  56 3 30
  57 1.6 16
  58 10.9 109
  60 1.51 15
  70 22.9 229
  73 4.4 44
  101 9.4 94
  115 0.76 8
  116 2.6 26
//