MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000278

2-PENTANOL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000278
RECORD_TITLE: 2-PENTANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

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CH$NAME: 2-PENTANOL
CH$NAME: SEC-AMYL ALCOHOL
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$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0a4i-9000000000-19815e3dcbfcbbccaa40
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
  15 1.8 18
  26 1.8 18
  27 10.8 108
  28 0.32 3
  29 9.9 99
  30 1.4 14
  31 48.1 481
  39 0.48 5
  41 24.7 247
  42 2.6 26
  43 3.3 33
  45 0.4 4
  55 2.7 27
  57 5.5 55
  58 9.6 96
  59 99.99 999
  60 3.7 37
//