ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005663
RECORD_TITLE: 6-PENTYL-2-PYRONE; 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

CH$NAME: 6-PENTYL-2-PYRONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄O₂
CH$EXACT_MASS: 166.09938
CH$SMILES: CCCCCC(=C1)OC(=O)C=C1
CH$IUPAC: InChI=1S/C10H14O2/c1-2-3-4-6-9-7-5-8-10(11)12-9/h5,7-8H,2-4,6H2,1H3
CH$LINK: INCHIKEY MAUFTTLGOUBZNA-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID0047589

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

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-000t-9200000000-022860393a31130e8775
PK$NUM_PEAK: 25
PK$PEAK: m/z int. rel.int.
  29 2.11 21
  39 23.43 234
  41 2.68 27
  43 2.58 26
  53 1.74 17
  55 3.15 32
  67 1.62 16
  68 22.91 229
  69 1.26 13
  81 48.06 481
  82 49.83 498
  83 3.26 33
  84 1.12 11
  93 1.03 10
  94 4.17 42
  95 99.99 999
  96 6.64 66
  109 1 10
  110 37.24 372
  111 1.66 17
  123 4.18 42
  138 12.42 124
  139 1.02 10
  166 19.62 196
  167 1.39 14
//