MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005669

2-PENTANOL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005669
RECORD_TITLE: 2-PENTANOL; 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$NAME: 2-PENTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₁₂O
CH$EXACT_MASS: 88.08882
CH$SMILES: CCCC(C)O
CH$IUPAC: InChI=1S/C5H12O/c1-3-4-5(2)6/h5-6H,3-4H2,1-2H3
CH$LINK: INCHIKEY JYVLIDXNZAXMDK-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3052721

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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$SPLASH: splash10-052e-9000000000-f0deb638d3edc45dc66a
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  27 7.63 76
  28 1 10
  29 9.34 93
  31 9.2 92
  39 2.53 25
  41 11.15 112
  42 5.73 57
  43 35.57 356
  44 22.65 227
  45 99.99 999
  46 6.68 67
  55 54.54 545
  56 2.66 27
  57 1.87 19
  69 1.15 12
  70 6.72 67
  71 19.1 191
  72 1.35 14
  73 28.48 285
  74 1.34 13
  87 2.49 25
  88 0.19 2
//