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N-Benzyl-2,4,5a,5b,5c,5D-hexahydro-cyclopropa(3,4)pentaleno(1,6-cd)piperidine
SpectraBase Compound ID EjVDIqV9Sm7
InChI InChI=1S/C17H17N/c1-2-4-13(5-3-1)10-18-11-16-8-6-14-7-9-17(16,12-18)15(14)16/h1-9,14-15H,10-12H2/t14?,15?,16-,17+
InChIKey NZUSOPFFHLUYMJ-UCUFBTAOSA-N
Mol Weight 235.33 g/mol
Molecular Formula C17H17N
Exact Mass 235.1361 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AF3wrhxCNjO
Name N-Benzyl-2,4,5a,5b,5c,5D-hexahydro-cyclopropa(3,4)pentaleno(1,6-cd)piperidine
CAS Registry Number 57595-54-7
Comments SEMIBULLVALENE REARRANGEMENT IS POSSIBLE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H17N
InChI InChI=1S/C17H17N/c1-2-4-13(5-3-1)10-18-11-16-8-6-14-7-9-17(16,12-18)15(14)16/h1-9,14-15H,10-12H2/t14?,15?,16-,17+
InChIKey NZUSOPFFHLUYMJ-UCUFBTAOSA-N
Instrument Name Bruker WH-90
Literature Reference L.A. Paquette, R.K. Russell, R.L.Burson, J. Am. Chem. Soc. 97, 6124 (1975).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3