ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009290
RECORD_TITLE: ACETALDEHYDE DIISOPROPYL 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$NAME: ACETALDEHYDE DIISOPROPYL ACETAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₈O₂
CH$EXACT_MASS: 146.13068
CH$SMILES: CC(C)OC(C)OC(C)C
CH$IUPAC: InChI=1S/C8H18O2/c1-6(2)9-8(5)10-7(3)4/h6-8H,1-5H3
CH$LINK: INCHIKEY TWWSMHPNERSWRN-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID30195534

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$SPLASH: splash10-000b-9000000000-3fe7863153b24076f2a0
PK$NUM_PEAK: 18
PK$PEAK: m/z int. rel.int.
  18 13.6 136
  20 1.5 15
  28 1.7 17
  39 0.49 5
  40 1.1 11
  41 8.8 88
  42 2.7 27
  43 5.33 53
  45 99.99 999
  47 4.2 42
  58 2.6 26
  59 0.91 9
  61 2.8 28
  69 4.1 41
  87 43.5 435
  88 0.15 2
  89 13 130
  131 8.2 82
//