MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009827

METHYL 4-PHENYL-2-OXO-3-BUTENOATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009827
RECORD_TITLE: METHYL 4-PHENYL-2-OXO-3-BUTENOATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA

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CH$NAME: METHYL 4-PHENYL-2-OXO-3-BUTENOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₁₀O₃
CH$EXACT_MASS: 190.06299
CH$SMILES: COC(=O)C(=O)C=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C11H10O3/c1-14-11(13)10(12)8-7-9-5-3-2-4-6-9/h2-8H,1H3/b8-7+
CH$LINK: INCHIKEY ZWDYRZGSCHGREX-BQYQJAHWSA-N

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AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-001i-2900000000-93d0a927c97390ca079c
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
  32 1.9 19
  45 3.3 33
  50 3 30
  51 1.06 11
  76 1.6 16
  77 20.2 202
  102 5 50
  103 4.25 43
  104 3.8 38
  128 1.6 16
  131 99.99 999
  132 0.95 10
  135 1.6 16
  148 1.6 16
  190 3.1 31
//