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(5,6-Dideuterio-2-exo-benzoyl-bicyclo(2.2.1)hept-2-yl) mesylate

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(5,6-Dideuterio-2-exo-benzoyl-bicyclo(2.2.1)hept-2-yl) mesylate
SpectraBase Compound ID vRjy4FBhWu
InChI InChI=1S/C15H18O4S/c1-18-20(17)19-15(10-11-7-8-13(15)9-11)14(16)12-5-3-2-4-6-12/h2-6,11,13H,7-10H2,1H3/t11-,13+,15-,20?/m1/s1/i7D,8D/t7-,8+,11+,13-,15+,20?/m0
InChIKey AMKSCSJMYKNXHH-QYCIIIGQSA-N
Mol Weight 296.38 g/mol
Molecular Formula C15H16D2O4S
Exact Mass 296.105134 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HH4FZ7YVLEu
Name (5,6-Dideuterio-2-exo-benzoyl-bicyclo(2.2.1)hept-2-yl) mesylate
CAS Registry Number 82043-82-1
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H16D2O4S
InChI InChI=1S/C15H18O4S/c1-18-20(17)19-15(10-11-7-8-13(15)9-11)14(16)12-5-3-2-4-6-12/h2-6,11,13H,7-10H2,1H3/t11-,13+,15-,20?/m1/s1/i7D,8D/t7-,8+,11+,13-,15+,20?/m0
InChIKey AMKSCSJMYKNXHH-QYCIIIGQSA-N
Instrument Name Varian XL-100
Literature Reference X. Creary, C.C. Geiger, J. Am. Chem. Soc. 104, 4151 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3