MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006161

2-BUTOXYETHANOL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006161
RECORD_TITLE: 2-BUTOXYETHANOL; 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

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CH$NAME: 2-BUTOXYETHANOL
CH$NAME: ETHYLENE GLYCOL MONOBUTYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄O₂
CH$EXACT_MASS: 118.09938
CH$SMILES: CCCCOCCO
CH$IUPAC: InChI=1S/C6H14O2/c1-2-3-5-8-6-4-7/h7H,2-6H2,1H3
CH$LINK: INCHIKEY POAOYUHQDCAZBD-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1024097

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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

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0a4i-9000000000-b90ed32396f13e81b974
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  27 3.69 37
  28 2.05 21
  29 42.77 428
  31 7.83 78
  41 37.66 377
  42 1.68 17
  43 3.55 36
  44 2.01 20
  45 48.48 485
  55 4.04 40
  56 9.18 92
  57 99.99 999
  58 4.08 41
  63 2 20
  71 3.27 33
  72 1.2 12
  73 1.1 11
  75 5.18 52
  87 11 110
  100 1.37 14
  118 0.15 2
//