ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007202
RECORD_TITLE: ISOPENTYL DECANOATE; 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$NAME: ISOPENTYL DECANOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₃₀O₂
CH$EXACT_MASS: 242.22458
CH$SMILES: CCCCCCCCCC(=O)OCCC(C)C
CH$IUPAC: InChI=1S/C15H30O2/c1-4-5-6-7-8-9-10-11-15(16)17-13-12-14(2)3/h14H,4-13H2,1-3H3
CH$LINK: INCHIKEY XDOGFYDZGUDBQY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7062320

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$SPLASH: splash10-00di-9000000000-587d40b1493d6deab483
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
  27 7 70
  29 11.09 111
  39 3.8 38
  41 22.14 221
  42 8.88 89
  43 45.13 451
  44 1.12 11
  45 1.07 11
  53 1.29 13
  54 1.06 11
  55 23.36 234
  56 3.18 32
  57 10.12 101
  60 3.39 34
  61 1.31 13
  67 1.23 12
  68 1.08 11
  69 6.99 70
  70 99.99 999
  71 39.1 391
  72 1.87 19
  73 3.68 37
  81 1.34 13
  83 1.79 18
  84 1.71 17
  85 3.1 31
  87 1.69 17
  95 1.29 13
  97 1.13 11
  98 1.38 14
  115 1.77 18
  129 2.32 23
  130 1.16 12
  143 1.25 13
  155 15.94 159
  156 1.61 16
  172 2.4 24
  173 5.98 60
  199 1.04 10
//