MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007983

PHENSUXIMIDE; CI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007983
RECORD_TITLE: PHENSUXIMIDE; 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

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CH$NAME: PHENSUXIMIDE
CH$NAME: 1-METHYL-3-PHENYL-2,5-PYRROLIDINEDIONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₁NO₂
CH$EXACT_MASS: 189.07898
CH$SMILES: O=C(C1)N(C)C(=O)C1c(c2)cccc2
CH$IUPAC: InChI=1S/C11H11NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
CH$LINK: INCHIKEY WLWFNJKHKGIJNW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4023460

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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

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PK$SPLASH: splash10-0006-0910000000-f0d2f8c20e993a067c81
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  58 1.21 12
  104 3.66 37
  105 1.52 15
  189 3.07 31
  190 99.99 999
  191 12.6 126
  192 1.11 11
  204 1.1 11
  218 14.29 143
  219 2.08 21
  230 5 50
//