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Carbonic acid, ethyl heptyl ester
SpectraBase Compound ID 1fnpRoIhq9a
InChI InChI=1S/C10H20O3/c1-3-5-6-7-8-9-13-10(11)12-4-2/h3-9H2,1-2H3
InChIKey PAYJWVSTMXSAHO-UHFFFAOYSA-N
Mol Weight 188.27 g/mol
Molecular Formula C10H20O3
Exact Mass 188.141245 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FhPGGWbKWym
Name Carbonic acid, ethyl heptyl ester
Comments Computed using HOSE algorithm
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Exact Mass 188.141244501 u
Formula C10H20O3
InChI InChI=1S/C10H20O3/c1-3-5-6-7-8-9-13-10(11)12-4-2/h3-9H2,1-2H3
InChIKey PAYJWVSTMXSAHO-UHFFFAOYSA-N
Molecular Weight 188.267 g/mol
SMILES CCOC(OCCCCCCC)=O