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ethyl 6-amino-5-cyano-4-(2-fluorophenyl)-2-propyl-4H-pyran-3-carboxylate

View entire compound with spectra: 2 NMR

ethyl 6-amino-5-cyano-4-(2-fluorophenyl)-2-propyl-4H-pyran-3-carboxylate
SpectraBase Compound ID LD1wbjms9pu
InChI InChI=1S/C18H19FN2O3/c1-3-7-14-16(18(22)23-4-2)15(12(10-20)17(21)24-14)11-8-5-6-9-13(11)19/h5-6,8-9,15H,3-4,7,21H2,1-2H3
InChIKey IXUZGTKABZUDOP-UHFFFAOYSA-N
Mol Weight 330.36 g/mol
Molecular Formula C18H19FN2O3
Exact Mass 330.137971 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6wwBe14CrJE
Name Ethyl 6-amino-5-cyano-4-(2-fluorophenyl)-2-propyl-4H-pyran-3-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.137970640 u
Formula C18H19FN2O3
InChI InChI=1S/C18H19FN2O3/c1-3-7-14-16(18(22)23-4-2)15(12(10-20)17(21)24-14)11-8-5-6-9-13(11)19/h5-6,8-9,15H,3-4,7,21H2,1-2H3
InChIKey IXUZGTKABZUDOP-UHFFFAOYSA-N
Molecular Weight 330.359 g/mol
SMILES NC=1OC(=C(C(C1C#N)C1=C(F)C=CC=C1)C(=O)OCC)CCC