MassBank Record: JP010143

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1,1-DIMETHOXY-1,2-DIPHENYL-2-OXOETHANE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: JP010143
RECORD_TITLE: 1,1-DIMETHOXY-1,2-DIPHENYL-2-OXOETHANE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: 1,1-DIMETHOXY-1,2-DIPHENYL-2-OXOETHANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H16O3
CH$EXACT_MASS: 256.10994
CH$SMILES: COC(OC)(c(c2)cccc2)C(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C16H16O3/c1-18-16(19-2,14-11-7-4-8-12-14)15(17)13-9-5-3-6-10-13/h3-12H,1-2H3
CH$LINK: INCHIKEY KWVGIHKZDCUPEU-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7037715

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

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0udi-2900000000-e8feae2af79e2d50f4dd
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  41 2 20
  43 2 20
  51 5 50
  55 0.2 2
  57 2 20
  59 5 50
  77 21 210
  91 0.9 9
  92 2 20
  105 32 320
  106 2 20
  151 99.99 999
  152 10 100
  225 4 40
//