MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007965

1,1-DIETHOXYNONANE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007965
RECORD_TITLE: 1,1-DIETHOXYNONANE; 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$NAME: 1,1-DIETHOXYNONANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₂₈O₂
CH$EXACT_MASS: 216.20893
CH$SMILES: CCCCCCCCC(OCC)OCC
CH$IUPAC: InChI=1S/C13H28O2/c1-4-7-8-9-10-11-12-13(14-5-2)15-6-3/h13H,4-12H2,1-3H3
CH$LINK: INCHIKEY RJMSGTVQHHFVLK-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7068976

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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$SPLASH: splash10-0udi-9700000000-c7c8f0e504515dc72740
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  15 1.1 11
  29 18.8 188
  31 8.8 88
  43 1.29 13
  47 20.5 205
  55 12.9 129
  57 34 340
  69 2.11 21
  75 25.2 252
  83 12.6 126
  85 27 270
  95 0.34 3
  103 99.99 999
  104 6.5 65
  113 1.3 13
  124 0.2 2
  127 2.7 27
  141 2.1 21
  171 22.9 229
  172 2.8 28
//