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ETHYL PROPIONATE; CI-B; MS

Mass Spectrum

Chemical Structure

metabolomics-usi visualisation

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005962
RECORD_TITLE: ETHYL PROPIONATE; CI-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

CH$NAME: ETHYL PROPIONATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₅H₁₀O₂
CH$EXACT_MASS: 102.06808
CH$SMILES: CCOC(=O)CC
CH$IUPAC: InChI=1S/C5H10O2/c1-3-5(6)7-4-2/h3-4H2,1-2H3
CH$LINK: INCHIKEY FKRCODPIKNYEAC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1040110

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 100 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE

PK$SPLASH: splash10-0fi0-9300000000-bad8e7bc515d11f68c2f
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  73 1.03 10
  74 60.87 609
  75 99.99 999
  76 2.82 28
  83 6.26 63
  84 5.41 54
  87 3.67 37
  102 32.77 328
  103 30.72 307
  104 2.05 21
//

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Responsible: Tillmann G. Fischer

Funded by the Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) under the National Research Data Infrastructure – NFDI4Chem – Projektnummer 441958208.