For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
1-Methoxy-16-bromo-dodecahedrane
SpectraBase Compound ID 2wvN2GJgXXK
InChI InChI=1S/C21H21BrO/c1-23-21-17-8-2-3-9(17)11-6-7-13(19(11)21)12-5-4(10(8)18(12)21)14(2)20(22,15(3)6)16(5)7/h2-19H,1H3
InChIKey TULRIWOOIXMAQT-UHFFFAOYSA-N
Mol Weight 369.3 g/mol
Molecular Formula C21H21BrO
Exact Mass 368.077578 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 49EjS4a2qT5
Name 1-Methoxy-16-bromo-dodecahedrane
CAS Registry Number 112896-56-7
Comments CHEMICAL BONDS BETWEEN C4,C15 AND C15,C14 AND C16,BR22 ARE NOT REPRESENTABLE
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C21H21BrO
InChI InChI=1S/C21H21BrO/c1-23-21-17-8-2-3-9(17)11-6-7-13(19(11)21)12-5-4(10(8)18(12)21)14(2)20(22,15(3)6)16(5)7/h2-19H,1H3
InChIKey TULRIWOOIXMAQT-UHFFFAOYSA-N
Literature Reference G.A. Olah, G.K. Prakash, L.A. Paquette, J. Am. Chem. Soc. 110, 1304 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3