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Ethyl 4,5-dimethyl-2-[(2-phenylbutanoyl)amino]-3-thiophenecarboxylate

View entire compound with spectra: 2 NMR

Ethyl 4,5-dimethyl-2-[(2-phenylbutanoyl)amino]-3-thiophenecarboxylate
SpectraBase Compound ID LsgIemVai2I
InChI InChI=1S/C19H23NO3S/c1-5-15(14-10-8-7-9-11-14)17(21)20-18-16(19(22)23-6-2)12(3)13(4)24-18/h7-11,15H,5-6H2,1-4H3,(H,20,21)
InChIKey UPGNACKWEGQRBG-UHFFFAOYSA-N
Mol Weight 345.46 g/mol
Molecular Formula C19H23NO3S
Exact Mass 345.139865 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H751bk1Xadf
Name Ethyl 4,5-dimethyl-2-[(2-phenylbutanoyl)amino]-3-thiophenecarboxylate
Comments Computed using HOSE algorithm
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Exact Mass 345.139864776 u
Formula C19H23NO3S
InChI InChI=1S/C19H23NO3S/c1-5-15(14-10-8-7-9-11-14)17(21)20-18-16(19(22)23-6-2)12(3)13(4)24-18/h7-11,15H,5-6H2,1-4H3,(H,20,21)
InChIKey UPGNACKWEGQRBG-UHFFFAOYSA-N
Molecular Weight 345.457 g/mol
SMILES N(C1=C(C(C)=C(S1)C)C(=O)OCC)C(C(C=1C=CC=CC1)CC)=O