ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006111
RECORD_TITLE: TRIPROPYLENEGLYCOL MONOMETHYL ETHER; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HASHIMOTO K, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: TRIPROPYLENEGLYCOL MONOMETHYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₂₂O₄
CH$EXACT_MASS: 206.15181
CH$SMILES: OCCCOCCCOCCCOC
CH$IUPAC: InChI=1S/C10H22O4/c1-12-6-3-8-14-10-4-9-13-7-2-5-11/h11H,2-10H2,1H3
CH$LINK: INCHIKEY GRTBNOKQBKPUGM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID00157003

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 100 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-00di-9510000000-4302d87384d4910b84c0
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  72 5.7 57
  73 99.99 999
  74 3.78 38
  99 1.41 14
  103 6.92 69
  115 1.27 13
  117 16.31 163
  118 1.19 12
  131 37.23 372
  132 2.84 28
  161 5.58 56
  189 1.62 16
  207 11.32 113
  208 1.3 13
//