ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006202
RECORD_TITLE: ETHYLENE GLYCOL MONOISOBUTYL 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$NAME: ETHYLENE GLYCOL MONOISOBUTYL ETHER
CH$NAME: 2-ISOBUTOXYETHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄O₂
CH$EXACT_MASS: 118.09938
CH$SMILES: OCCOCC(C)C
CH$IUPAC: InChI=1S/C6H14O2/c1-6(2)5-8-4-3-7/h6-7H,3-5H2,1-2H3
CH$LINK: INCHIKEY HHAPGMVKBLELOE-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3063469

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$SPLASH: splash10-014i-1900000000-af04b415d8d8b39f1b5e
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  71 2.48 25
  72 1.95 20
  73 4.19 42
  75 11.15 112
  85 1.05 11
  87 6.9 69
  100 2.62 26
  101 1.32 13
  103 7.62 76
  117 6.43 64
  119 99.99 999
  120 23.01 230
  121 2.15 22
  237 5.76 58
//