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1-piperidinecarboxamide, 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-b]pyridin-11-ylidene)-N-(1-methylethyl)-
SpectraBase Compound ID 28biiATC6wo
InChI InChI=1S/C23H26ClN3O/c1-15(2)26-23(28)27-12-9-16(10-13-27)21-20-8-7-19(24)14-18(20)6-5-17-4-3-11-25-22(17)21/h3-4,7-8,11,14-15H,5-6,9-10,12-13H2,1-2H3,(H,26,28)
InChIKey SNRWZSZYGGDQEC-UHFFFAOYSA-N
Mol Weight 395.93 g/mol
Molecular Formula C23H26ClN3O
Exact Mass 395.17644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9mqUFJClTKH
Name 1-Piperidinecarboxamide, 4-(8-chloro-5,6-dihydro-11H-benzo[5,6]cyclohepta[1,2-B]pyridin-11-ylidene)-N-(1-methylethyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 395.176440168 u
Formula C23H26ClN3O
InChI InChI=1S/C23H26ClN3O/c1-15(2)26-23(28)27-12-9-16(10-13-27)21-20-8-7-19(24)14-18(20)6-5-17-4-3-11-25-22(17)21/h3-4,7-8,11,14-15H,5-6,9-10,12-13H2,1-2H3,(H,26,28)
InChIKey SNRWZSZYGGDQEC-UHFFFAOYSA-N
Molecular Weight 395.934 g/mol
SMILES N(C(N1CCC(=C2C3=C(C=C(C=C3)Cl)CCC3=C2N=CC=C3)CC1)=O)C(C)C