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Methyl 1-.beta.-(Benzyloxy)-6.beta.-[(tert-butyldimethylsilyloxy)methyl]-4.alpha.-(4'-methylbenzenesulfoamido)cyclohex-2-enecarboxylate
SpectraBase Compound ID LD69KohcqcB
InChI InChI=1S/C29H41NO6SSi/c1-22-13-15-26(16-14-22)37(32,33)30-25-17-18-29(27(31)34-5,35-20-23-11-9-8-10-12-23)24(19-25)21-36-38(6,7)28(2,3)4/h8-18,24-25,30H,19-21H2,1-7H3/t24-,25-,29-/m1/s1
InChIKey SKIGYXUFTDZXFS-ITLAICGJSA-N
Mol Weight 559.8 g/mol
Molecular Formula C29H41NO6SSi
Exact Mass 559.242386 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7V1XuIWkLZD
Name Methyl 1-.beta.-(Benzyloxy)-6.beta.-[(tert-butyldimethylsilyloxy)methyl]-4.alpha.-(4'-methylbenzenesulfoamido)cyclohex-2-enecarboxylate
CAS Registry Number 141684-42-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H41NO6SSi
InChI InChI=1S/C29H41NO6SSi/c1-22-13-15-26(16-14-22)37(32,33)30-25-17-18-29(27(31)34-5,35-20-23-11-9-8-10-12-23)24(19-25)21-36-38(6,7)28(2,3)4/h8-18,24-25,30H,19-21H2,1-7H3/t24-,25-,29-/m1/s1
InChIKey SKIGYXUFTDZXFS-ITLAICGJSA-N
Molecular Weight 559.793 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)[C@@]1(C=C[C@@]([C@](C1)(CO[Si](C(C)(C)C)(C)C)[H])(C(=O)OC)OCc1ccccc1)[H]
SPLASH splash10-0006-9300000000-b6810dca3dd3a54df2db
Source of Spectrum J-57-4097-10bh
Synonyms (1R,4S,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-[(4-methylphenyl)sulfonylamino]-1-phenylmethoxy-1-cyclohex-2-enecarboxylic acid methyl ester Methyl (1R,4S,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-[(4-methylphenyl)sulfonylamino]-1-phenylmethoxycyclohex-2-ene-1-carboxylate Methyl (1R,4S,6R)-1-benzyloxy-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(p-tolylsulfonylamino)cyclohex-2-ene-1-carboxylate Methyl (1R,4S,6R)-6-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-[(4-methylphenyl)sulfonylamino]-1-phenylmethoxy-cyclohex-2-ene-1-carboxylate
Wiley ID 1405581