MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009077

ISOPROPYL PYRUVATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009077
RECORD_TITLE: ISOPROPYL PYRUVATE; 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$NAME: ISOPROPYL PYRUVATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₆H₁₀O₃
CH$EXACT_MASS: 130.06299
CH$SMILES: CC(C)OC(=O)C(C)=O
CH$IUPAC: InChI=1S/C6H10O3/c1-4(2)9-6(8)5(3)7/h4H,1-3H3
CH$LINK: INCHIKEY WUBJISGMPZWFKY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID20433351

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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$SPLASH: splash10-0006-9000000000-a24ff788bb55ab4f0cc4
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  14 1.23 12
  15 6.62 66
  27 12.03 120
  29 2.29 23
  39 5.72 57
  41 21.17 212
  42 4.45 45
  43 99.99 999
  44 3.26 33
  45 1.57 16
  59 1.27 13
  71 1.64 16
  87 2.09 21
//