ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007982
RECORD_TITLE: METHSUXIMIDE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA

CH$NAME: METHSUXIMIDE
CH$NAME: 1,3-DIMETHYL-3-PHENYL-2,5-PYRROLIDINEDIONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₃NO₂
CH$EXACT_MASS: 203.09463
CH$SMILES: O=C(C1)N(C)C(=O)C(C)1c(c2)cccc2
CH$IUPAC: InChI=1S/C12H13NO2/c1-12(9-6-4-3-5-7-9)8-10(14)13(2)11(12)15/h3-7H,8H2,1-2H3
CH$LINK: INCHIKEY AJXPJJZHWIXJCJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5023293

AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 200 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE

PK$SPLASH: splash10-0udi-0090000000-31b6e0b0429306f0d6da
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  118 3.63 36
  119 1.04 10
  203 2.65 27
  204 99.99 999
  205 13.85 139
  206 1.39 14
  232 14.54 145
  233 2.3 23
  244 5.19 52
//