ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008079
RECORD_TITLE: CARBITOL; EI-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$NAME: CARBITOL
CH$NAME: 2-(2-ETHOXYETHOXY)ETHANOL
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$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-006t-9000000000-b49c9922c7da1f2f7486
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  27 1.32 13
  28 2.65 27
  29 8.18 82
  31 30.33 303
  33 1.93 19
  41 2.05 21
  43 6.26 63
  44 5.54 55
  45 99.99 999
  46 2.77 28
  47 1.44 14
  59 48.5 485
  60 13.24 132
  61 2.65 27
  62 2.41 24
  72 43.56 436
  73 18.17 182
  74 1.2 12
  75 8.42 84
  89 1.68 17
  101 2.05 21
  103 5.17 52
  104 7.46 75
  116 0.96 10
//