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N-Chlorocarbamoyl-2-oxa-3-aza-bicyclo(2.2.2)octane
SpectraBase Compound ID HZ97MhbXz9A
InChI InChI=1S/C7H10ClNO2/c8-7(10)9-5-1-3-6(11-9)4-2-5/h5-6H,1-4H2/t5-,6+
InChIKey OVVACBAADLLNQS-OLQVQODUSA-N
Mol Weight 175.61 g/mol
Molecular Formula C7H10ClNO2
Exact Mass 175.040006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CUBfPKlHeYo
Name N-Chlorocarbamoyl-2-oxa-3-aza-bicyclo(2.2.2)octane
CAS Registry Number 110589-99-6
Comments ISOMER 2 HIGH FIELD SHIFTS (FROZEN AMIDE ROTATION)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H10ClNO2
InChI InChI=1S/C7H10ClNO2/c8-7(10)9-5-1-3-6(11-9)4-2-5/h5-6H,1-4H2/t5-,6+
InChIKey OVVACBAADLLNQS-OLQVQODUSA-N
Literature Reference S. Nelsen, J. Thompson-Colon, B. Kirste, J. Am. Chem. Soc. 109, 7128 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3