ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006246
RECORD_TITLE: METHYL CAPRATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: METHYL CAPRATE
CH$NAME: METHYL DECANOATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₂₂O₂
CH$EXACT_MASS: 186.16198
CH$SMILES: CCCCCCCCCC(=O)OC
CH$IUPAC: InChI=1S/C11H22O2/c1-3-4-5-6-7-8-9-10-11(12)13-2/h3-10H2,1-2H3
CH$LINK: CAS 110-42-9
CH$LINK: INCHIKEY YRHYCMZPEVDGFQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4026842

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-00dl-9100000000-c96b4aca87b5230e393d
PK$NUM_PEAK: 65
PK$PEAK: m/z int. rel.int.
  39 2.33 23
  40 0.7 7
  41 22.37 224
  42 5.02 50
  43 20.23 202
  44 0.76 8
  45 0.97 10
  53 0.9 9
  54 1.01 10
  55 14.98 150
  56 3.31 33
  57 6.96 70
  58 0.43 4
  59 7.76 78
  60 0.27 3
  67 1.17 12
  68 0.9 9
  69 7.89 79
  70 1.63 16
  71 3.48 35
  72 0.27 3
  73 1.68 17
  74 99.99 999
  75 10.34 103
  76 0.66 7
  79 0.3 3
  81 1.05 11
  82 0.51 5
  83 3.22 32
  84 2.79 28
  85 1.68 17
  86 0.13 1
  87 46.69 467
  88 4.69 47
  89 0.35 4
  95 0.75 8
  96 0.15 2
  97 2.07 21
  98 1.78 18
  99 0.24 2
  100 0.15 2
  101 5.69 57
  102 0.44 4
  110 0.43 4
  111 0.62 6
  112 1.15 12
  113 0.21 2
  115 1.44 14
  116 0.39 4
  125 0.33 3
  126 0.15 2
  129 3.88 39
  130 0.45 5
  143 13.08 131
  144 1.26 13
  145 0.12 1
  153 0.2 2
  154 0.12 1
  155 8.05 81
  156 0.87 9
  157 2.25 23
  158 0.3 3
  186 4.64 46
  187 1.13 11
  188 0.11 1
//