MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008207

1-OCTEN-3-OL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008207
RECORD_TITLE: 1-OCTEN-3-OL; 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$NAME: 1-OCTEN-3-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₆O
CH$EXACT_MASS: 128.12012
CH$SMILES: CCCCCC(O)C=C
CH$IUPAC: InChI=1S/C8H16O/c1-3-5-6-7-8(9)4-2/h4,8-9H,2-3,5-7H2,1H3
CH$LINK: INCHIKEY VSMOENVRRABVKN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3035214

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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 20 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0a4i-9000000000-7670346176174380f380
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  41 8.82 88
  42 4.41 44
  43 32.35 324
  44 2.94 29
  45 0.88 9
  54 5.88 59
  55 11.76 118
  56 3.53 35
  57 99.99 999
  58 15.59 156
  67 5.29 53
  68 9.41 94
  69 2.94 29
  70 0.88 9
  71 5.59 56
  72 45.59 456
  73 3.82 38
  81 8.82 88
  82 8.82 88
  83 2.94 29
  85 20.29 203
  95 2.35 24
  99 11.18 112
  110 0.87 9
//