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10-Carbomethoxy-10-phenoxymethyl-octacyclo(7.7.2.1/2,15/.0/3,18/.0/4,8/.0/5,19/.0/11,17/.0/12,16/)nonadecane
SpectraBase Compound ID G5WjHA16dVa
InChI InChI=1S/C28H32O3/c1-30-27(29)28(11-31-12-5-3-2-4-6-12)25-15-9-7-13-17-14-8-10-16-19(14)22-20(17)21(18(13)15)23(25)24(22)26(16)28/h2-6,13-26H,7-11H2,1H3
InChIKey VJYWVOALKMJEJP-UHFFFAOYSA-N
Mol Weight 416.6 g/mol
Molecular Formula C28H32O3
Exact Mass 416.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DZxboVpzulq
Name 10-Carbomethoxy-10-phenoxymethyl-octacyclo(7.7.2.1/2,15/.0/3,18/.0/4,8/.0/5,19/.0/11,17/.0/12,16/)nonadecane
CAS Registry Number 82390-76-9
Comments CHEMICAL BOND BETWEEN C-5 AND C-19 NOT REPRESENTABLE
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C28H32O3
InChI InChI=1S/C28H32O3/c1-30-27(29)28(11-31-12-5-3-2-4-6-12)25-15-9-7-13-17-14-8-10-16-19(14)22-20(17)21(18(13)15)23(25)24(22)26(16)28/h2-6,13-26H,7-11H2,1H3
InChIKey VJYWVOALKMJEJP-UHFFFAOYSA-N
Instrument Name Bruker WP-80
Literature Reference L.A. Paquette, R.J. Ternansky, D.W.Balogh, J. Am. Chem. Soc. 105, 5446 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3