ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008731
RECORD_TITLE: GAMMA-UNDECALACTONE; 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$NAME: GAMMA-UNDECALACTONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₂₀O₂
CH$EXACT_MASS: 184.14633
CH$SMILES: CCCCCCCC(C1)OC(=O)C1
CH$IUPAC: InChI=1S/C11H20O2/c1-2-3-4-5-6-7-10-8-9-11(12)13-10/h10H,2-9H2,1H3
CH$LINK: INCHIKEY PHXATPHONSXBIL-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4034287

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$SPLASH: splash10-000i-9000000000-3cc053772b2ab360bfdb
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
  27 11.42 114
  28 4.21 42
  29 25.64 256
  39 5.66 57
  40 1.1 11
  41 18.15 182
  42 4.98 50
  43 10.26 103
  44 1.13 11
  53 1.67 17
  54 2.17 22
  55 13.39 134
  56 10.89 109
  57 7.41 74
  60 1.15 12
  67 2.03 20
  68 2.2 22
  69 5.57 56
  70 2.98 30
  71 1.58 16
  72 2.07 21
  73 1.41 14
  81 1.75 18
  82 1.93 19
  83 2.59 26
  84 3.86 39
  85 99.99 999
  86 3.69 37
  87 1.08 11
  95 1.4 14
  96 1.7 17
  97 1.37 14
  98 1.32 13
  100 3.9 39
  101 1.72 17
  110 1.28 13
  114 1.88 19
  122 1.17 12
  124 1.49 15
  125 1.4 14
  127 1.73 17
  128 7.33 73
//