MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003598

2-ETHYLHEXANOL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003598
RECORD_TITLE: 2-ETHYLHEXANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

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CH$NAME: 2-ETHYLHEXANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₈O
CH$EXACT_MASS: 130.13577
CH$SMILES: CCCCC(CC)CO
CH$IUPAC: InChI=1S/C8H18O/c1-3-5-6-8(4-2)7-9/h8-9H,3-7H2,1-2H3
CH$LINK: INCHIKEY YIWUKEYIRIRTPP-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID5020605

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AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0a4l-9000000000-95177f2f4a0e7724cc32
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  27 21 210
  29 26.3 263
  35 15.9 159
  39 1.38 14
  41 50.5 505
  43 44 440
  57 99.99 999
  72 0.92 9
  128 1.8 18
//