ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008656
RECORD_TITLE: PROPANAL DIHEXYL 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$NAME: PROPANAL DIHEXYL ACETAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₃₂O₂
CH$EXACT_MASS: 244.24023
CH$SMILES: CCCCCCOC(CC)OCCCCCC
CH$IUPAC: InChI=1S/C15H32O2/c1-4-7-9-11-13-16-15(6-3)17-14-12-10-8-5-2/h15H,4-14H2,1-3H3
CH$LINK: INCHIKEY GAGIWYOKONINOF-UHFFFAOYSA-N

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$SPLASH: splash10-000f-9100000000-739aad222e2e2ec7f572
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
  27 9.75 98
  29 16.14 161
  31 4.47 45
  39 4.6 46
  41 24.61 246
  42 9.08 91
  43 94.38 944
  44 2.49 25
  55 11.19 112
  56 10.45 105
  57 15.47 155
  58 6.23 62
  59 39.16 392
  60 1.03 10
  69 2.26 23
  71 1.25 13
  75 1.13 11
  85 99.99 999
  86 6.31 63
  131 5.78 58
  143 35.9 359
  144 2.74 27
  215 6.3 63
//