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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003654

1-PHENYLPROPAN-2-ONE; EI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003654
RECORD_TITLE: 1-PHENYLPROPAN-2-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA

CH$NAME: 1-PHENYLPROPAN-2-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10O
CH$EXACT_MASS: 134.07316
CH$SMILES: CC(=O)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C9H10O/c1-8(10)7-9-5-3-2-4-6-9/h2-6H,7H2,1H3
CH$LINK: INCHIKEY QCCDLTOVEPVEJK-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1059280

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0006-9200000000-c0bdd6d0dc94032c721c
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  39 9 90
  41 2 20
  43 99.99 999
  44 0.2 2
  50 3 30
  51 5 50
  62 2 20
  63 0.06 1
  64 2 20
  65 16 160
  77 3 30
  89 0.05 1
  90 3 30
  91 90 900
  92 28 280
  105 0.02 0
  134 55 550
  135 5 50
//

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