MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007977

TRIMETHADION; CI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007977
RECORD_TITLE: TRIMETHADION; 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$NAME: TRIMETHADION
CH$NAME: 1,3,3-TRIMETHYL-2,4-OXAZOLIDINEDIONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₉NO₃
CH$EXACT_MASS: 143.05824
CH$SMILES: O=C(O1)N(C)C(=O)C(C)(C)1
CH$IUPAC: InChI=1S/C6H9NO3/c1-6(2)4(8)7(3)5(9)10-6/h1-3H3
CH$LINK: INCHIKEY IRYJRGCIQBGHIV-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9021396

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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$SPLASH: splash10-0006-1900000000-5560efcfc7260e1dcfef
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  57 2.06 21
  58 2.35 24
  59 7.56 76
  69 1.11 11
  70 1.25 13
  73 1.57 16
  82 1.4 14
  100 4.85 49
  143 1.47 15
  144 99.99 999
  145 7.31 73
  172 4.61 46
  184 3.36 34
//