MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002247

2,3-DIMETHYL-1-PHENYL-3-BUTEN-1-ONE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002247
RECORD_TITLE: 2,3-DIMETHYL-1-PHENYL-3-BUTEN-1-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

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CH$NAME: 2,3-DIMETHYL-1-PHENYL-3-BUTEN-1-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₁₄O
CH$EXACT_MASS: 174.10447
CH$SMILES: CC(=C)C(C)C(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C12H14O/c1-9(2)10(3)12(13)11-7-5-4-6-8-11/h4-8,10H,1H2,2-3H3
CH$LINK: INCHIKEY WBQKHEBUULKXGU-UHFFFAOYSA-N

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AC$INSTRUMENT: JEOL JMS-D-3000
AC$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$SPLASH: splash10-0a4i-1900000000-c282e2332ec10180cc72
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  41 2.15 22
  77 12.02 120
  105 99.99 999
  106 7.5 75
  159 1.26 13
  174 3.09 31
//