ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001763
RECORD_TITLE: 1,2-BENZENEDICARBOXYLIC ACID DECYL METHYLESTER; 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$NAME: 1,2-BENZENEDICARBOXYLIC ACID DECYL METHYLESTER
CH$NAME: METHYLDECYL PHTHALATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₉H₂₈O₄
CH$EXACT_MASS: 320.19876
CH$SMILES: CCCCCCCCCCOC(=O)c(c1)c(ccc1)C(=O)OC
CH$IUPAC: InChI=1S/C19H28O4/c1-3-4-5-6-7-8-9-12-15-23-19(21)17-14-11-10-13-16(17)18(20)22-2/h10-11,13-14H,3-9,12,15H2,1-2H3
CH$LINK: INCHIKEY OXRWHMFJAPZSRT-UHFFFAOYSA-N

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-03dj-1900000000-0096cac668a4cd23ae06
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
  27 0.18 2
  28 3.04 30
  29 0.57 6
  43 1.08 11
  55 4.93 49
  56 5.85 59
  57 3.73 37
  68 0.56 6
  69 4.15 42
  70 5.68 57
  71 2.01 20
  77 1.58 16
  82 0.6 6
  83 3.26 33
  84 2.24 22
  85 1.1 11
  91 0.48 5
  92 1.87 19
  97 1.79 18
  98 1 10
  104 0.76 8
  105 1.62 16
  111 0.67 7
  112 0.98 10
  132 0.28 3
  133 0.62 6
  135 2.29 23
  136 2.11 21
  140 0.72 7
  149 89.16 892
  150 7.73 77
  151 0.77 8
  163 99.99 999
  164 11.17 112
  165 0.98 10
  181 28.23 282
  182 2.14 21
  208 0.11 1
//