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2-Ethyl-6-methylcarbanilic acid, cyclohexyl ester
SpectraBase Compound ID TA2JKhLFgx
InChI InChI=1S/C16H23NO2/c1-3-13-9-7-8-12(2)15(13)17-16(18)19-14-10-5-4-6-11-14/h7-9,14H,3-6,10-11H2,1-2H3,(H,17,18)
InChIKey KZUWHIXNYZOCPN-UHFFFAOYSA-N
Mol Weight 261.36 g/mol
Molecular Formula C16H23NO2
Exact Mass 261.172879 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6TF9DzfqjV4
Name 2-Ethyl-6-methylcarbanilic acid, cyclohexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 261.172878983 u
Formula C16H23NO2
InChI InChI=1S/C16H23NO2/c1-3-13-9-7-8-12(2)15(13)17-16(18)19-14-10-5-4-6-11-14/h7-9,14H,3-6,10-11H2,1-2H3,(H,17,18)
InChIKey KZUWHIXNYZOCPN-UHFFFAOYSA-N
Molecular Weight 261.365 g/mol
SMILES N(C1=C(C=CC=C1CC)C)C(OC1CCCCC1)=O