MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008635

ACETALDEHYDE DIETHYL ACETAL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008635
RECORD_TITLE: ACETALDEHYDE DIETHYL ACETAL; 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$NAME: ACETALDEHYDE DIETHYL ACETAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄O₂
CH$EXACT_MASS: 118.09938
CH$SMILES: CCOC(C)OCC
CH$IUPAC: InChI=1S/C6H14O2/c1-4-7-6(3)8-5-2/h6H,4-5H2,1-3H3
CH$LINK: INCHIKEY DHKHKXVYLBGOIT-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID6030607

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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$SPLASH: splash10-0002-9000000000-1f9d4f5641ee98603aa4
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  15 4.56 46
  19 1.44 14
  26 2.07 21
  27 14.14 141
  29 16.43 164
  30 1.11 11
  31 5.57 56
  42 1.38 14
  43 18.92 189
  44 7.02 70
  45 99.99 999
  46 2.79 28
  47 19.54 195
  61 3.37 34
  72 1.54 15
  73 59.64 596
  74 2.7 27
  75 6.23 62
  103 15.33 153
//