MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009882

1,3-DIPHENYLACETONE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009882
RECORD_TITLE: 1,3-DIPHENYLACETONE; 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$NAME: 1,3-DIPHENYLACETONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₁₄O
CH$EXACT_MASS: 210.10447
CH$SMILES: O=C(Cc(c2)cccc2)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C15H14O/c16-15(11-13-7-3-1-4-8-13)12-14-9-5-2-6-10-14/h1-10H,11-12H2
CH$LINK: CAS 102-04-5
CH$LINK: INCHIKEY YFKBXYGUSOXJGS-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5059244

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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$SPLASH: splash10-0006-9200000000-8fe40f45465094b7fef7
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  39 3.7 37
  51 1.5 15
  63 2.5 25
  65 15.5 155
  89 3 30
  90 3 30
  91 99.99 999
  92 11.6 116
  118 13.3 133
  119 24 240
  120 1.5 15
  210 11.5 115
  211 1.7 17
//