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cis-2-Acetyl-3-phenyl-2,3,3a,4,5,6-hexahydro-benzo(6,7)cyclohepta(1,2-C)pyrazole
SpectraBase Compound ID 4YZ42ZjZBX0
InChI InChI=1S/C20H20N2O/c1-14(23)22-20(16-9-3-2-4-10-16)18-13-7-11-15-8-5-6-12-17(15)19(18)21-22/h2-6,8-10,12,18,20H,7,11,13H2,1H3
InChIKey LXUSCZWDPVAGSZ-UHFFFAOYSA-N
Mol Weight 304.39 g/mol
Molecular Formula C20H20N2O
Exact Mass 304.157563 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 63dfXeLLH6p
Name trans-2-Acetyl-3-phenyl-2,3,3a,4,5,6-hexahydro-benzo(6,7)cyclohepta(1,2-C)pyrazole
Comments 67.2 MHZ SPECTRUM
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H20N2O
InChI InChI=1S/C20H20N2O/c1-14(23)22-20(16-9-3-2-4-10-16)18-13-7-11-15-8-5-6-12-17(15)19(18)21-22/h2-6,8-10,12,18,20H,7,11,13H2,1H3
InChIKey LXUSCZWDPVAGSZ-UHFFFAOYSA-N
Instrument Name see comment
Literature Reference A. Szoelloesy, G. Toth, T. Lorand, J. Chem. Soc. Perkin II 489 (1991).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3