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2-Chloro-10-(2,5-dimethyl-phenyl)-10-thio-xanthenium (+)-camphor-10-sulfonate

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2-Chloro-10-(2,5-dimethyl-phenyl)-10-thio-xanthenium (+)-camphor-10-sulfonate
SpectraBase Compound ID 6kg48j4vEKy
InChI InChI=1S/C31H33ClO4S2/c1-20-9-10-21(2)28(15-20)38(26-8-6-5-7-22(26)16-23-17-25(32)11-12-27(23)38)36-37(34,35)19-31-14-13-24(18-29(31)33)30(31,3)4/h5-12,15,17,24H,13-14,16,18-19H2,1-4H3/t24-,31-/m0/s1
InChIKey KDAGGXOWXNRUCO-DLLPINGYSA-N
Mol Weight 569.2 g/mol
Molecular Formula C31H33ClO4S2
Exact Mass 568.15088 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KkWfJIVN3dP
Name 2-Chloro-10-(2,5-dimethyl-phenyl)-10-thio-xanthenium (+)-camphor-10-sulfonate
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C31H33ClO4S2
InChI InChI=1S/C31H33ClO4S2/c1-20-9-10-21(2)28(15-20)38(26-8-6-5-7-22(26)16-23-17-25(32)11-12-27(23)38)36-37(34,35)19-31-14-13-24(18-29(31)33)30(31,3)4/h5-12,15,17,24H,13-14,16,18-19H2,1-4H3/t24-,31-/m0/s1
InChIKey KDAGGXOWXNRUCO-DLLPINGYSA-N
Instrument Name Varian XL-100
Literature Reference C.A. Maryanoff, K.S. Hayes, K. Mislow, J. Am. Chem. Soc. 99, 4412 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3