ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009220
RECORD_TITLE: BENZYL 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$NAME: BENZYL DECANOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₇H₂₆O₂
CH$EXACT_MASS: 262.19328
CH$SMILES: CCCCCCCCCC(=O)OCc(c1)cccc1
CH$IUPAC: InChI=1S/C17H26O2/c1-2-3-4-5-6-7-11-14-17(18)19-15-16-12-9-8-10-13-16/h8-10,12-13H,2-7,11,14-15H2,1H3
CH$LINK: INCHIKEY ZSAYVPCIKVBDRI-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID20194995

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$SPLASH: splash10-0006-9200000000-4773fa1dcfc89b83f46c
PK$NUM_PEAK: 44
PK$PEAK: m/z int. rel.int.
  27 8.9 89
  29 13.1 131
  39 7.8 78
  41 2.55 26
  42 4.7 47
  43 26.8 268
  51 3.5 35
  53 0.17 2
  54 1.1 11
  55 12.8 128
  56 3 30
  57 1.22 12
  63 1.9 19
  65 12 120
  67 1.2 12
  68 0.12 1
  69 10 100
  70 1.2 12
  71 7.5 75
  73 0.11 1
  77 4.9 49
  78 1.5 15
  79 5 50
  81 0.15 2
  83 3.2 32
  84 1.6 16
  85 3.8 38
  89 0.27 3
  90 5.9 59
  91 99.99 999
  92 18.6 186
  93 0.14 1
  95 1.8 18
  97 2.7 27
  105 1.9 19
  107 0.41 4
  108 41.2 412
  109 2.8 28
  111 2.7 27
  135 0.22 2
  153 4.1 41
  155 4 40
  171 3.7 37
  262 1.4 14
//