ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010516
RECORD_TITLE: BENZOFUROXAN; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA

CH$NAME: BENZOFUROXAN
CH$NAME: BENZOFURAN 1-OXIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₄N₂O₂
CH$EXACT_MASS: 136.02728
CH$SMILES: [O-1][n+1](o1)c(c2)c(ccc2)n1
CH$IUPAC: InChI=1S/C6H4N2O2/c9-8-6-4-2-1-3-5(6)7-10-8/h1-4H
CH$LINK: CAS 480-96-6
CH$LINK: INCHIKEY OKEAMBAZBICIFP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5060063

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$SPLASH: splash10-000i-5900000000-202be0166d74a0b16576
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  27 2.2 22
  28 1.08 11
  30 15.09 151
  37 2.15 22
  38 2.31 23
  39 4.8 48
  50 13.35 134
  51 12.65 127
  52 3.9 39
  62 1.31 13
  63 3.24 32
  64 2.15 22
  74 4.26 43
  75 3.7 37
  76 11.47 115
  77 1.24 12
  78 4.61 46
  90 1.06 11
  120 1.4 14
  136 99.99 999
  137 35.07 351
  138 3.26 33
//