ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008697
RECORD_TITLE: GERANAL; 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$NAME: GERANAL
CH$NAME: TRANS-3,7-DIMETHYL-2,6-OCTADIENAL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₆O
CH$EXACT_MASS: 152.12012
CH$SMILES: O=CC=C(C)CCC=C(C)C
CH$IUPAC: InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7+
CH$LINK: INCHIKEY WTEVQBCEXWBHNA-JXMROGBWSA-N
CH$LINK: COMPTOX DTXSID20881217

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$SPLASH: splash10-00kf-9000000000-90723459c49195367705
PK$NUM_PEAK: 41
PK$PEAK: m/z int. rel.int.
  27 14.26 143
  29 7.66 77
  39 23.59 236
  40 2.12 21
  41 87.5 875
  42 3.89 39
  43 3.69 37
  50 1.15 12
  51 2.86 29
  52 1.32 13
  53 10.37 104
  54 2.33 23
  55 5.49 55
  56 2.85 29
  59 3.1 31
  65 2.4 24
  67 6.92 69
  68 2.19 22
  69 99.99 999
  70 5.33 53
  77 2.95 30
  79 2.69 27
  80 1.57 16
  81 5.24 52
  82 3.68 37
  83 7.19 72
  84 25.02 250
  85 1.41 14
  91 2.77 28
  93 1.46 15
  94 13.03 130
  95 3.22 32
  107 1.12 11
  108 1.22 12
  109 6.37 64
  110 1.04 10
  119 1.85 19
  123 5.49 55
  134 1.19 12
  137 4.45 45
  152 4.39 44
//