ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006164
RECORD_TITLE: HEXYL CELLOSOLVE; EI-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$NAME: HEXYL CELLOSOLVE
CH$NAME: 2-HEXYLOXYETHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₈O₂
CH$EXACT_MASS: 146.13068
CH$SMILES: CCCCCCOCCO
CH$IUPAC: InChI=1S/C8H18O2/c1-2-3-4-5-7-10-8-6-9/h9H,2-8H2,1H3
CH$LINK: INCHIKEY UPGSWASWQBLSKZ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1026908

AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-0006-9000000000-13e324fc188eff2d694f
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
  27 2.44 24
  29 7.07 71
  31 2.44 24
  41 12.38 124
  42 4.07 41
  43 99.99 999
  44 4.11 41
  45 36.53 365
  55 7.51 75
  56 11.61 116
  57 11.37 114
  63 12.89 129
  69 1.95 20
  75 4.74 47
  83 7.87 79
  84 4.98 50
  85 27.22 272
  86 1.73 17
  115 1.37 14
  146 0.21 2
//