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

View entire compound with spectra: 1 NMR

(2S-(2-ALPHA(R),3A-ALPHA,4-BETA,7-BETA,7A-ALPHA))-(PHENYLMETHYL)-N-2-(2-CHLORO-4,5-DI-(PHENYLMETHOXY)-PHENYL)-2-((OCTAHYDRO-7,7,7-TRIMETHYL-4,7-ME
SpectraBase Compound ID ARIvs2TAhiv
InChI InChI=1S/C42H46ClNO6/c1-41(2)33-19-20-42(41,3)39-31(33)22-38(50-39)49-37(24-44-40(45)48-27-30-17-11-6-12-18-30)32-21-35(46-25-28-13-7-4-8-14-28)36(23-34(32)43)47-26-29-15-9-5-10-16-29/h4-18,21,23,31,33,37-39H,19-20,22,24-27H2,1-3H3,(H,44,45)/t31-,33-,37-,38-,39-,42+/m1/s1
InChIKey QXIGEXXQAKSIRC-RGTGIPKBSA-N
Mol Weight 696.3 g/mol
Molecular Formula C42H46ClNO6
Exact Mass 695.301366 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5YJb2g4KsB5
Name (2S-(2-ALPHA(R),3A-ALPHA,4-BETA,7-BETA,7A-ALPHA))-(PHENYLMETHYL)-N-2-(2-CHLORO-4,5-DI-(PHENYLMETHOXY)-PHENYL)-2-((OCTAHYDRO-7,7,7-TRIMETHYL-4,7-ME
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C42H46ClNO6
InChI InChI=1S/C42H46ClNO6/c1-41(2)33-19-20-42(41,3)39-31(33)22-38(50-39)49-37(24-44-40(45)48-27-30-17-11-6-12-18-30)32-21-35(46-25-28-13-7-4-8-14-28)36(23-34(32)43)47-26-29-15-9-5-10-16-29/h4-18,21,23,31,33,37-39H,19-20,22,24-27H2,1-3H3,(H,44,45)/t31-,33-,37-,38-,39-,42+/m1/s1
InChIKey QXIGEXXQAKSIRC-RGTGIPKBSA-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 696.283 g/mol
Solvent CDCl3
Source File Reference UWMP739