ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004948
RECORD_TITLE: DIMETHYL PHTHALATE; 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$NAME: DIMETHYL PHTHALATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₀O₄
CH$EXACT_MASS: 194.05791
CH$SMILES: COC(=O)c(c1)c(ccc1)C(=O)OC
CH$IUPAC: InChI=1S/C10H10O4/c1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h3-6H,1-2H3
CH$LINK: INCHIKEY NIQCNGHVCWTJSM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3022455

AC$INSTRUMENT: JEOL JMS-D-3000
AC$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$SPLASH: splash10-03di-3900000000-e194a5ec6782fe9c8422
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  50 6.5 65
  51 2.34 23
  52 1.49 15
  63 1.09 11
  64 1.89 19
  66 1.54 15
  74 1.9 19
  75 2.19 22
  76 8.05 81
  77 18.71 187
  78 1.33 13
  79 1.3 13
  92 6.43 64
  104 4.69 47
  105 2.76 28
  120 2.01 20
  133 3.85 39
  135 6.88 69
  163 99.99 999
  164 10.54 105
  165 1.14 11
  194 7.15 72
//