MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007044

3-DECANONE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007044
RECORD_TITLE: 3-DECANONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

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CH$NAME: 3-DECANONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₂₀O
CH$EXACT_MASS: 156.15142
CH$SMILES: CCCCCCCC(=O)CC
CH$IUPAC: InChI=1S/C10H20O/c1-3-5-6-7-8-9-10(11)4-2/h3-9H2,1-2H3
CH$LINK: INCHIKEY XJLDYKIEURAVBW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2061303

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AC$INSTRUMENT: HITACHI M-80B
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0adl-9000000000-b30cfbbcc6f4484764aa
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  26 1.2 12
  27 20.56 206
  29 51 510
  39 9.32 93
  41 27.74 277
  42 7.03 70
  43 31.47 315
  44 1.03 10
  53 1.96 20
  55 10.48 105
  56 2.68 27
  57 99.99 999
  58 3.93 39
  67 2.04 20
  69 1.02 10
  71 1.47 15
  72 60.61 606
  73 10.99 110
  82 1.15 12
  83 1.02 10
  85 10.23 102
  109 2.33 23
  127 22.08 221
  128 1.71 17
  156 2.18 22
//