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2-Chloro-3,3-dimethyl-2-aza-bicyclo(2.2.2)octane
SpectraBase Compound ID EJB0Lu6wdNN
InChI InChI=1S/C9H16ClN/c1-9(2)7-3-5-8(6-4-7)11(9)10/h7-8H,3-6H2,1-2H3/t7-,8+
InChIKey QXAJHBBZOYRVOK-OCAPTIKFSA-N
Mol Weight 173.69 g/mol
Molecular Formula C9H16ClN
Exact Mass 173.097127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LDy3fXeRMFU
Name 2-Chloro-3,3-dimethyl-2-aza-bicyclo(2.2.2)octane
CAS Registry Number 82666-06-6
Comments FROZEN CONFORMATION IN CF2CL2/CD2CL2 (2/1)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H16ClN
InChI InChI=1S/C9H16ClN/c1-9(2)7-3-5-8(6-4-7)11(9)10/h7-8H,3-6H2,1-2H3/t7-,8+
InChIKey QXAJHBBZOYRVOK-OCAPTIKFSA-N
Literature Reference S.F. Nelsen, P.M. Gannett, J. Am. Chem. Soc. 104, 5292 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany