ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011096
RECORD_TITLE: BENZAMIDE; 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$NAME: BENZAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₇NO
CH$EXACT_MASS: 121.05276
CH$SMILES: NC(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)
CH$LINK: CAS 55-21-0
CH$LINK: INCHIKEY KXDAEFPNCMNJSK-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0021709

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$SPLASH: splash10-0adi-7900000000-c79bab8ceedf3b276ae1
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  16 1.2 12
  27 2.32 23
  28 1.18 12
  37 1.62 16
  38 2.6 26
  39 3.53 35
  44 8.91 89
  49 1.38 14
  50 13.43 134
  51 29.62 296
  52 4.66 47
  63 1.17 12
  65 1.42 14
  73 1.27 13
  74 5.67 57
  75 3.21 32
  76 4.99 50
  77 71.31 713
  78 9.87 99
  104 1.34 13
  105 99.99 999
  106 7.83 78
  121 91.29 913
  122 8.97 90
//