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Ethyl 2-[N-(2'-(cyanocyclopent-1'-enyl)amino]-3-(4'-methoxyphenyl)propanoate
SpectraBase Compound ID ATekrrT9J4y
InChI InChI=1S/C18H22N2O3/c1-3-23-18(21)17(20-16-6-4-5-14(16)12-19)11-13-7-9-15(22-2)10-8-13/h7-10,17,20H,3-6,11H2,1-2H3
InChIKey CWGIGAUUHJFNSM-UHFFFAOYSA-N
Mol Weight 314.38 g/mol
Molecular Formula C18H22N2O3
Exact Mass 314.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1UwgotZPsln
Name Ethyl 2-[N-(2'-(cyanocyclopent-1'-enyl)amino]-3-(4'-methoxyphenyl)propanoate
Alternate Name(s) Ethyl 2-[(2-cyano-1-cyclopenten-1-yl)amino]-3-(4-methoxyphenyl)propanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22N2O3
InChI InChI=1S/C18H22N2O3/c1-3-23-18(21)17(20-16-6-4-5-14(16)12-19)11-13-7-9-15(22-2)10-8-13/h7-10,17,20H,3-6,11H2,1-2H3
InChIKey CWGIGAUUHJFNSM-UHFFFAOYSA-N
Molecular Weight 314.385 g/mol
SMILES N(C1=C(C#N)CCC1)C(C(=O)OCC)Cc1ccc(cc1)OC
SPLASH splash10-00di-0901000000-8b5d54ce9924fc9507b2
Source of Spectrum H-78-120-2
Wiley ID 1315155