ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001722
RECORD_TITLE: NONANEDIOIC ACID DIMETHYL ESTER; CI-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$NAME: NONANEDIOIC ACID DIMETHYL ESTER
CH$NAME: DIMETHYL AZELATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₁H₂₀O₄
CH$EXACT_MASS: 216.13616
CH$SMILES: COC(=O)CCCCCCCC(=O)OC
CH$IUPAC: InChI=1S/C11H20O4/c1-14-10(12)8-6-4-3-5-7-9-11(13)15-2/h3-9H2,1-2H3
CH$LINK: INCHIKEY DRUKNYVQGHETPO-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1044807

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-00kr-1940000000-f8843790d7de0c022d8e
PK$NUM_PEAK: 82
PK$PEAK: m/z int. rel.int.
  65 0.11 1
  67 0.46 5
  68 0.65 7
  69 2.18 22
  70 0.24 2
  71 0.48 5
  72 0.13 1
  74 4.19 42
  75 0.86 9
  77 0.17 2
  79 0.18 2
  80 0.4 4
  81 1.09 11
  82 0.91 9
  83 4.64 46
  84 3.33 33
  85 0.25 3
  87 1.76 18
  88 0.25 3
  91 0.12 1
  93 0.48 5
  95 0.79 8
  96 0.74 7
  97 2.81 28
  98 1.23 12
  99 0.28 3
  101 0.96 10
  105 0.2 2
  107 0.66 7
  109 0.28 3
  110 0.41 4
  111 2.67 27
  112 0.23 2
  113 0.25 3
  114 0.12 1
  115 0.43 4
  123 1.82 18
  124 2.14 21
  125 3.71 37
  126 0.9 9
  127 0.31 3
  128 0.47 5
  129 0.19 2
  130 0.23 2
  133 0.31 3
  134 0.18 2
  135 0.62 6
  137 0.19 2
  141 0.22 2
  142 0.22 2
  143 4.16 42
  144 0.36 4
  151 12.08 121
  152 6.52 65
  153 2.72 27
  154 0.27 3
  155 0.8 8
  156 0.88 9
  157 13.67 137
  159 1.24 12
  160 0.2 2
  167 0.18 2
  171 0.1 1
  183 7.88 79
  184 3.14 31
  185 99.99 999
  186 29.44 294
  187 4.49 45
  188 0.38 4
  203 0.11 1
  215 0.77 8
  217 71.83 718
  218 24.42 244
  219 2.65 27
  220 0.23 2
  231 0.36 4
  243 0.48 5
  245 0.14 1
  255 0.85 9
  256 0.12 1
  257 2.15 22
  258 0.33 3
//