ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007440
RECORD_TITLE: 2-(2-BUTOXYETHOXY)ETHANOL; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 2-(2-BUTOXYETHOXY)ETHANOL
CH$NAME: BUTYL CARBITOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₈O₃
CH$EXACT_MASS: 162.12559
CH$SMILES: CCCCOCCOCCO
CH$IUPAC: InChI=1S/C8H18O3/c1-2-3-5-10-7-8-11-6-4-9/h9H,2-8H2,1H3
CH$LINK: CAS 112-34-5
CH$LINK: INCHIKEY OAYXUHPQHDHDDZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8021519

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-03di-1900000000-8aef03e0bb456b96d1a4
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  73 1.75 18
  75 1.03 10
  85 1.96 20
  87 3.63 36
  88 0.53 5
  89 9.44 94
  90 0.54 5
  100 1.42 14
  101 6.71 67
  102 0.52 5
  105 0.52 5
  107 19.08 191
  108 0.96 10
  119 0.52 5
  132 0.53 5
  144 0.58 6
  145 0.56 6
  161 1.31 13
  163 99.99 999
  164 9.28 93
  165 1.06 11
//