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Tert-butyl 2-[(E)2-oxo-4-phenylbut-3-en-1-yl]pyrrolidine-1-carboxylate
SpectraBase Compound ID BoApS3A2dzK
InChI InChI=1S/C19H25NO3/c1-19(2,3)23-18(22)20-13-7-10-16(20)14-17(21)12-11-15-8-5-4-6-9-15/h4-6,8-9,11-12,16H,7,10,13-14H2,1-3H3/b12-11+
InChIKey ORCWHYIQALBIBC-VAWYXSNFSA-N
Mol Weight 315.41 g/mol
Molecular Formula C19H25NO3
Exact Mass 315.183444 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CkxKwW8EEAN
Name Tert-butyl 2-[(E)2-oxo-4-phenylbut-3-en-1-yl]pyrrolidine-1-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 315.183443666 u
Formula C19H25NO3
InChI InChI=1S/C19H25NO3/c1-19(2,3)23-18(22)20-13-7-10-16(20)14-17(21)12-11-15-8-5-4-6-9-15/h4-6,8-9,11-12,16H,7,10,13-14H2,1-3H3/b12-11+
InChIKey ORCWHYIQALBIBC-VAWYXSNFSA-N
Molecular Weight 315.413 g/mol
SMILES C(N1C(CC(\C=C\C2=CC=CC=C2)=O)CCC1)(OC(C)(C)C)=O