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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-3'-phenylpropanoate

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-3'-phenylpropanoate
SpectraBase Compound ID HNwPfPit1LH
InChI InChI=1S/C39H57NO4SSi/c1-38(2)31-25-26-39(38,29-45(42,43)40(32-19-11-6-12-20-32)33-21-13-7-14-22-33)36(27-31)44-37(41)28-35(30-17-9-5-10-18-30)46(3,4)34-23-15-8-16-24-34/h5,8-10,15-18,23-24,31-33,35-36H,6-7,11-14,19-22,25-29H2,1-4H3/t31-,35+,36-,39-/m1/s1
InChIKey FODRLYFGKCYYES-PRDAVTMWSA-N
Mol Weight 664.0 g/mol
Molecular Formula C39H57NO4SSi
Exact Mass 663.377757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5gK53n6kHUL
Name (1S,2R,4R)-1-(N,N-Dicyclohexylaminosulfonylmethyl)-7,7-dimethylbicyclo[2.2.1]heptan-2-yl (3'S)-3'-dimethyl(phenyl)silyl-3'-phenylpropanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C39H57NO4SSi
InChI InChI=1S/C39H57NO4SSi/c1-38(2)31-25-26-39(38,29-45(42,43)40(32-19-11-6-12-20-32)33-21-13-7-14-22-33)36(27-31)44-37(41)28-35(30-17-9-5-10-18-30)46(3,4)34-23-15-8-16-24-34/h5,8-10,15-18,23-24,31-33,35-36H,6-7,11-14,19-22,25-29H2,1-4H3/t31-,35+,36-,39-/m1/s1
InChIKey FODRLYFGKCYYES-PRDAVTMWSA-N
Molecular Weight 664.033 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)(c1ccccc1)[H])=O)[H])(C)C
SPLASH splash10-000i-0900000000-a9324cf53cf86f6afd5b
Source of Spectrum KC-0-309-2
Synonyms (1S,2R,4R)-1-{[(dicyclohexylamino)sulfonyl]methyl}-7,7-dimethylbicyclo[2.2.1]hept-2-yl (3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoate
Wiley ID 782978