MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008556

1-ETHYLPENTYL ACETATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008556
RECORD_TITLE: 1-ETHYLPENTYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

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CH$NAME: 1-ETHYLPENTYL ACETATE
CH$NAME: 3-HEPTYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₈O₂
CH$EXACT_MASS: 158.13068
CH$SMILES: CCCCC(CC)OC(C)=O
CH$IUPAC: InChI=1S/C9H18O2/c1-4-6-7-9(5-2)11-8(3)10/h9H,4-7H2,1-3H3
CH$LINK: INCHIKEY QICIMADZMWGDTQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID60904737

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AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0006-9100000000-a8948f9763f7c40c7da0
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  15 1.73 17
  27 6.89 69
  29 8.77 88
  31 1 10
  39 3.07 31
  41 10.63 106
  42 2.4 24
  43 99.99 999
  44 2.73 27
  55 5.89 59
  56 9.17 92
  57 6.82 68
  58 2.44 24
  59 1.77 18
  61 1.55 16
  69 6.66 67
  70 2.89 29
  73 1.32 13
  98 6.19 62
  101 13.91 139
  129 8.44 84
//