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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007642

N-BUTYLACETAMID; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007642
RECORD_TITLE: N-BUTYLACETAMID; 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$NAME: N-BUTYLACETAMID
CH$NAME: ACETYLAMIN0BUTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H13NO
CH$EXACT_MASS: 115.09971
CH$SMILES: CCCCNC(C)=O
CH$IUPAC: InChI=1S/C6H13NO/c1-3-4-5-7-6(2)8/h3-5H2,1-2H3,(H,7,8)
CH$LINK: CAS 1119-49-9
CH$LINK: INCHIKEY GYLDXXLJMRTVSS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2061511

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$SPLASH: splash10-00e9-9100000000-331b154c0f8098133111
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  30 99.99 999
  31 3.01 30
  41 1.61 16
  43 7.33 73
  44 35.07 351
  45 3.92 39
  56 3.3 33
  57 2.37 24
  58 6.66 67
  60 17.54 175
  72 54.33 543
  73 74.03 740
  74 3.11 31
  86 30.22 302
  87 3.33 33
  100 28.51 285
  101 1.76 18
  115 34.1 341
  116 6.68 67
//

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