MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007039

2-NONANONE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007039
RECORD_TITLE: 2-NONANONE; 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$NAME: 2-NONANONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₈O
CH$EXACT_MASS: 142.13577
CH$SMILES: CCCCCCCC(C)=O
CH$IUPAC: InChI=1S/C9H18O/c1-3-4-5-6-7-8-9(2)10/h3-8H2,1-2H3
CH$LINK: INCHIKEY VKCYHJWLYTUGCC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2022125

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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$SPLASH: splash10-0a4l-9000000000-d4d90ed2a739f3ba43a2
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  15 3.86 39
  27 13.83 138
  29 14.35 144
  39 9.45 95
  41 22.57 226
  42 5.87 59
  43 98.6 986
  44 2.07 21
  53 1.56 16
  55 7.73 77
  56 2.17 22
  57 21.21 212
  58 99.99 999
  59 21.94 219
  67 1.28 13
  69 1.26 13
  71 21.42 214
  72 1.26 13
  82 2.12 21
  84 2.93 29
  85 3.46 35
  99 1.24 12
  127 1.61 16
  142 4.84 48
//