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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008632

DECANAL DIMETHYL ACETAL; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008632
RECORD_TITLE: DECANAL DIMETHYL 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

CH$NAME: DECANAL DIMETHYL ACETAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H26O2
CH$EXACT_MASS: 202.19328
CH$SMILES: CCCCCCCCCC(OC)OC
CH$IUPAC: InChI=1S/C12H26O2/c1-4-5-6-7-8-9-10-11-12(13-2)14-3/h12H,4-11H2,1-3H3
CH$LINK: INCHIKEY NCRNCSZWOOYBQF-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3064803

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

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-004i-9000000000-362896b800f5af033836
PK$NUM_PEAK: 27
PK$PEAK: m/z int. rel.int.
  15 1.11 11
  27 4.01 40
  29 6.16 62
  31 3.43 34
  39 2.66 27
  41 13.59 136
  42 1.65 17
  43 6.32 63
  45 6.2 62
  47 5.09 51
  55 7.3 73
  57 2.54 25
  58 5.74 57
  67 1.76 18
  68 1.62 16
  69 4.8 48
  71 23.58 236
  72 1.11 11
  75 99.99 999
  76 3.22 32
  81 1.56 16
  82 1.66 17
  83 5.95 60
  85 1.22 12
  95 1.26 13
  97 2.46 25
  171 5.69 57
//

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