MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006286

BUTYROPHENONE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006286
RECORD_TITLE: BUTYROPHENONE; 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$NAME: BUTYROPHENONE
CH$NAME: PHENYL N-PROPYL KETONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₂O
CH$EXACT_MASS: 148.08882
CH$SMILES: CCCC(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C10H12O/c1-2-6-10(11)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3
CH$LINK: CAS 495-40-9
CH$LINK: INCHIKEY FFSAXUULYPJSKH-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3047059

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AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 35 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0a6r-8900000000-5ba81f3a023b4c52f97a
PK$NUM_PEAK: 11
PK$PEAK: m/z int. rel.int.
  28 12.45 125
  39 3.97 40
  41 7.73 77
  43 24.34 243
  65 3.2 32
  76 2.82 28
  77 51.39 514
  79 4.03 40
  105 99.99 999
  106 6.41 64
  148 9.82 98
//