MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005423

2-METHYL-1-PENTANOL; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005423
RECORD_TITLE: 2-METHYL-1-PENTANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

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CH$NAME: 2-METHYL-1-PENTANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₄O
CH$EXACT_MASS: 102.10447
CH$SMILES: CCCC(C)CO
CH$IUPAC: InChI=1S/C6H14O/c1-3-4-6(2)5-7/h6-7H,3-5H2,1-2H3
CH$LINK: INCHIKEY PFNHSEQQEPMLNI-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID9026714

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AC$INSTRUMENT: HITACHI RMU-7M
AC$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$SPLASH: splash10-0006-9000000000-eb5f827647062d21f333
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
  15 1.12 11
  27 11.47 115
  28 1.65 17
  29 16.19 162
  31 13.64 136
  39 8.4 84
  40 1.5 15
  41 25.49 255
  42 15.89 159
  43 99.99 999
  44 3.52 35
  45 3.15 32
  53 1.5 15
  55 21.89 219
  56 17.62 176
  57 4.42 44
  59 1.87 19
  69 21.14 211
  70 26.69 267
  71 32.23 322
  72 1.87 19
  83 1.42 14
  84 11.24 112
  85 12.59 126
//