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MassBank Record: JP008212

(2E,6Z)-2,6-NONADIENAL; EI-B; MS

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

ACCESSION: JP008212
RECORD_TITLE: (2E,6Z)-2,6-NONADIENAL; 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

CH$NAME: (2E,6Z)-2,6-NONADIENAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H14O
CH$EXACT_MASS: 138.10447
CH$SMILES: CCC([H])=C([H])CCC([H])=C([H])C=O
CH$IUPAC: InChI=1S/C9H14O/c1-2-3-4-5-6-7-8-9-10/h3-4,7-9H,2,5-6H2,1H3/b4-3+,8-7-
CH$LINK: INCHIKEY HZYHMHHBBBSGHB-UTUPVWNLSA-N

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 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-01bc-9000000000-51b8bdf2de3bfeb16e26
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
  41 99.99 999
  42 6.17 62
  53 5.29 53
  54 3.24 32
  67 15.71 157
  68 6.47 65
  69 85.29 853
  70 94.12 941
  71 6.17 62
  79 3.24 32
  80 2.35 24
  81 4.71 47
  83 1.47 15
  91 1.18 12
  95 3.24 32
  109 2.94 29
//

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