ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001289
RECORD_TITLE: 3,6,9-TRIOXADECANE-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$NAME: 3,6,9-TRIOXADECANE-1-OL
CH$NAME: TRIETHYLENE GLYCOL MONOMETHYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₁₆O₄
CH$EXACT_MASS: 164.10486
CH$SMILES: COCCOCCOCCO
CH$IUPAC: InChI=1S/C7H16O4/c1-9-4-5-11-7-6-10-3-2-8/h8H,2-7H2,1H3
CH$LINK: INCHIKEY JLGLQAWTXXGVEM-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5026912

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$SPLASH: splash10-0a4j-9000000000-562841fb0856c2a8cd69
PK$NUM_PEAK: 29
PK$PEAK: m/z int. rel.int.
  15 9.44 94
  19 3.25 33
  26 1.27 13
  27 7.94 79
  28 8.57 86
  29 24.21 242
  30 1.83 18
  31 26.59 266
  33 1.19 12
  41 1.43 14
  42 1.19 12
  43 10.48 105
  44 9.6 96
  45 99.99 999
  46 2.3 23
  57 1.59 16
  58 33.02 330
  59 79.37 794
  60 3.57 36
  73 1.19 12
  75 3.17 32
  87 4.21 42
  88 3.17 32
  89 16.75 168
  90 1.19 12
  101 1.19 12
  102 2.22 22
  103 3.1 31
  119 2.06 21
//