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(2S-(2-ALPHA(R),3A-ALPHA,4-BETA,7-BETA,7A-ALPHA))-(PHENYLMETHYL)-N-(2-(3-CHLORO-4,5-DI-(PHENYLMETHOXY)-PHENYL)-2-((OCTAHYDRO-7,8,8-TRIMETHYL-4,7-M

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(2S-(2-ALPHA(R),3A-ALPHA,4-BETA,7-BETA,7A-ALPHA))-(PHENYLMETHYL)-N-(2-(3-CHLORO-4,5-DI-(PHENYLMETHOXY)-PHENYL)-2-((OCTAHYDRO-7,8,8-TRIMETHYL-4,7-M
SpectraBase Compound ID LBrLnvhq21G
InChI InChI=1S/C43H48ClNO6/c1-42(2)34-20-21-43(42,3)40-33(34)24-38(51-40)50-37(25-45(4)41(46)49-28-31-18-12-7-13-19-31)32-22-35(44)39(48-27-30-16-10-6-11-17-30)36(23-32)47-26-29-14-8-5-9-15-29/h5-19,22-23,33-34,37-38,40H,20-21,24-28H2,1-4H3/t33-,34-,37-,38-,40-,43+/m1/s1
InChIKey XSIUFUYPNVQOIE-ICOXSZSPSA-N
Mol Weight 710.3 g/mol
Molecular Formula C43H48ClNO6
Exact Mass 709.317016 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EDjGSeBbU8x
Name (2S-(2-ALPHA(R),3A-ALPHA,4-BETA,7-BETA,7A-ALPHA))-(PHENYLMETHYL)-N-(2-(3-CHLORO-4,5-DI-(PHENYLMETHOXY)-PHENYL)-2-((OCTAHYDRO-7,8,8-TRIMETHYL-4,7-M
Compound Number 9B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C43H48ClNO6
InChI InChI=1S/C43H48ClNO6/c1-42(2)34-20-21-43(42,3)40-33(34)24-38(51-40)50-37(25-45(4)41(46)49-28-31-18-12-7-13-19-31)32-22-35(44)39(48-27-30-16-10-6-11-17-30)36(23-32)47-26-29-14-8-5-9-15-29/h5-19,22-23,33-34,37-38,40H,20-21,24-28H2,1-4H3/t33-,34-,37-,38-,40-,43+/m1/s1
InChIKey XSIUFUYPNVQOIE-ICOXSZSPSA-N
Literature Reference Author M.KNOLLMUELLER,P.GAERTNER,J.PERNERSTORFER,P.POJARLIEV,H.B.ST EGMANN
Literature Reference Citation MH.CHEM.,130,451(1999)
Literature Reference DOI 10.1007/s007060050204
Molecular Weight 710.310 g/mol
Solvent CDCl3
Source File Reference UWMP744