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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006300

BENZANILIDE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006300
RECORD_TITLE: BENZANILIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: BENZANILIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H11NO
CH$EXACT_MASS: 197.08406
CH$SMILES: O=C(Nc(c2)cccc2)c(c1)cccc1
CH$IUPAC: InChI=1S/C13H11NO/c15-13(11-7-3-1-4-8-11)14-12-9-5-2-6-10-12/h1-10H,(H,14,15)
CH$LINK: CAS 93-98-1
CH$LINK: INCHIKEY ZVSKZLHKADLHSD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9059096

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-0a4i-7900000000-beaf1f14ef82e35fd664
PK$NUM_PEAK: 30
PK$PEAK: m/z int. rel.int.
  27 1.76 18
  28 1.23 12
  38 2.17 22
  39 8.76 88
  40 0.97 10
  41 0.53 5
  50 5.61 56
  51 17.61 176
  52 2.23 22
  62 0.79 8
  63 2.65 27
  64 2.02 20
  65 10.13 101
  66 1.53 15
  74 1.48 15
  75 1.24 12
  76 2.15 22
  77 47.47 475
  78 4.11 41
  91 1.05 11
  92 3.37 34
  93 3.27 33
  105 99.99 999
  106 7.78 78
  167 0.67 7
  180 2.44 24
  181 0.56 6
  197 33.56 336
  198 8.37 84
  199 0.91 9
//

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