ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008343
RECORD_TITLE: DIISOPROPYL PHTHALATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UBE SCIENTIFIC ANALYSIS LABORATORY
LICENSE: CC BY-NC-SA

CH$NAME: DIISOPROPYL PHTHALATE
CH$NAME: PHTHALIC ACID DIISOPROPYL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₄H₁₈O₄
CH$EXACT_MASS: 250.12051
CH$SMILES: CC(C)OC(=O)c(c1)c(ccc1)C(=O)OC(C)C
CH$IUPAC: InChI=1S/C14H18O4/c1-9(2)17-13(15)11-7-5-6-8-12(11)14(16)18-10(3)4/h5-10H,1-4H3
CH$LINK: COMPTOX DTXSID2040731
CH$LINK: INCHIKEY QWDBCIAVABMJPP-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:11799

AC$INSTRUMENT: HITACHI M-60
AC$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$SPLASH: splash10-0002-5900000000-d74b235e94b9ed720db1
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  15 1.98 20
  27 7.95 80
  39 5.94 59
  41 11.08 111
  42 2.44 24
  43 18.48 185
  45 2.15 22
  50 4.55 46
  51 1.62 16
  59 4.82 48
  65 7.33 73
  66 1.91 19
  75 1.29 13
  76 9.18 92
  77 2.95 30
  93 4.92 49
  104 7.94 79
  105 7.35 74
  121 3.82 38
  122 7.14 71
  123 1.07 11
  149 99.99 999
  150 11.97 120
  151 1.37 14
  167 4.06 41
  191 4.61 46
  192 5.51 55
  209 7.01 70
  251 1.77 18
//