MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005674

1-HEXANOL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005674
RECORD_TITLE: 1-HEXANOL; 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$NAME: 1-HEXANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄O
CH$EXACT_MASS: 102.10447
CH$SMILES: CCCCCCO
CH$IUPAC: InChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3
CH$LINK: INCHIKEY ZSIAUFGUXNUGDI-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8021931

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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$SPLASH: splash10-0a4l-9000000000-612a7e611628b904745f
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  27 2.24 22
  29 6.12 61
  31 8.88 89
  39 1.57 16
  41 20.97 210
  42 28.6 286
  43 41.38 414
  44 1.82 18
  45 2 20
  54 2.37 24
  55 44.88 449
  56 99.99 999
  57 7.14 71
  68 1 10
  69 34.27 343
  70 3.76 38
  71 2.06 21
  73 2.08 21
  83 2.72 27
  84 17.85 179
  85 3.89 39
//