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(1S,2R,4R)-1-(N,N-Dicyclohexylaminosulfonylmethyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-yl (3'S)-3'-dimethyl(phenyl)silyl-4'-methylpentanoate

View entire compound with spectra: 1 MS (GC)

(1S,2R,4R)-1-(N,N-Dicyclohexylaminosulfonylmethyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-yl (3'S)-3'-dimethyl(phenyl)silyl-4'-methylpentanoate
SpectraBase Compound ID JdJ00XwDCIy
InChI InChI=1S/C36H59NO4SSi/c1-27(2)32(43(5,6)31-20-14-9-15-21-31)25-34(38)41-33-24-28-22-23-36(33,35(28,3)4)26-42(39,40)37(29-16-10-7-11-17-29)30-18-12-8-13-19-30/h9,14-15,20-21,27-30,32-33H,7-8,10-13,16-19,22-26H2,1-6H3/t28-,32+,33-,36-/m1/s1
InChIKey SWHNEUTXHKEPRA-NSSVONMISA-N
Mol Weight 630.0 g/mol
Molecular Formula C36H59NO4SSi
Exact Mass 629.393407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6pZ1bdj4Ltt
Name (1S,2R,4R)-1-(N,N-Dicyclohexylaminosulfonylmethyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-yl (3'S)-3'-dimethyl(phenyl)silyl-4'-methylpentanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H59NO4SSi
InChI InChI=1S/C36H59NO4SSi/c1-27(2)32(43(5,6)31-20-14-9-15-21-31)25-34(38)41-33-24-28-22-23-36(33,35(28,3)4)26-42(39,40)37(29-16-10-7-11-17-29)30-18-12-8-13-19-30/h9,14-15,20-21,27-30,32-33H,7-8,10-13,16-19,22-26H2,1-6H3/t28-,32+,33-,36-/m1/s1
InChIKey SWHNEUTXHKEPRA-NSSVONMISA-N
Molecular Weight 630.016 g/mol
SMILES C(S(N(C1CCCCC1)C1CCCCC1)(=O)=O)[C@@]12C([C@]([H])(CC2)C[C@]1(OC(C[C@]([Si](c1ccccc1)(C)C)(C(C)C)[H])=O)[H])(C)C
SPLASH splash10-000i-0901000000-559cc3991b9c1067869c
Source of Spectrum KC-0-310-11
Synonyms (1S,2R,4R)-1-{[(dicyclohexylamino)sulfonyl]methyl}-7,7-dimethylbicyclo[2.2.1]hept-2-yl (3S)-3-[dimethyl(phenyl)silyl]-4-methylpentanoate
Wiley ID 782976