ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008730
RECORD_TITLE: GAMMA-DECALACTONE; 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$NAME: GAMMA-DECALACTONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₈O₂
CH$EXACT_MASS: 170.13068
CH$SMILES: CCCCCCC(C1)OC(=O)C1
CH$IUPAC: InChI=1S/C10H18O2/c1-2-3-4-5-6-9-7-8-10(11)12-9/h9H,2-8H2,1H3
CH$LINK: INCHIKEY IFYYFLINQYPWGJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4022109

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$SPLASH: splash10-000i-9000000000-4b166790a11e7c302d92
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
  26 1.03 10
  27 11.36 114
  28 5.9 59
  29 23.41 234
  39 5.03 50
  40 1.02 10
  41 15.67 157
  42 4.09 41
  43 10.45 105
  53 1.37 14
  54 1.62 16
  55 10.9 109
  56 6.57 66
  57 4.87 49
  58 1.25 13
  67 1.13 11
  68 1.5 15
  69 3.07 31
  70 3.13 31
  71 1.05 11
  72 1.55 16
  81 1.3 13
  83 1.47 15
  84 2.4 24
  85 99.99 999
  86 3.68 37
  97 1.11 11
  100 3.56 36
  110 1.59 16
  111 1.24 12
  113 1.8 18
  114 1.42 14
  128 7.83 78
//