ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001288
RECORD_TITLE: 3,6-DIOXAOCTANE-1-OL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: 3,6-DIOXAOCTANE-1-OL
CH$NAME: DIETHYLENE GLYCOL MONOETHYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H14O3
CH$EXACT_MASS: 134.09429
CH$SMILES: CCOCCOCCO
CH$IUPAC: InChI=1S/C6H14O3/c1-2-8-5-6-9-4-3-7/h7H,2-6H2,1H3
CH$LINK: INCHIKEY XXJWXESWEXIICW-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2021941
AC$INSTRUMENT: HITACHI RMU-7M
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: splash10-0002-9000000000-571a681a0c459379a0c7
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  15 3.47 35
  19 3.91 39
  27 9.33 93
  28 4.1 41
  29 17.28 173
  31 34.87 349
  41 3.15 32
  42 1.01 10
  43 10.21 102
  44 6.56 66
  45 99.99 999
  46 2.46 25
  59 35.31 353
  60 9.27 93
  61 2.46 25
  62 1.45 15
  72 20.18 202
  73 12.17 122
  75 5.04 50
  103 2.46 25
  104 3.28 33
//
