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(1S)-1-[5-(tert-Butyldiphenylsilyl)oxymethyl]2-(p-toluenesulfonyl)aminophenylmethyl]-5,6-dimethyl-2-methylene-5-heptenyl acetate

View entire compound with spectra: 1 MS (GC)

(1S)-1-[5-(tert-Butyldiphenylsilyl)oxymethyl]2-(p-toluenesulfonyl)aminophenylmethyl]-5,6-dimethyl-2-methylene-5-heptenyl acetate
SpectraBase Compound ID 4KBC8nDR4AP
InChI InChI=1S/C43H53NO5SSi/c1-31(2)33(4)22-23-34(5)42(49-35(6)45)29-37-28-36(24-27-41(37)44-50(46,47)38-25-20-32(3)21-26-38)30-48-51(43(7,8)9,39-16-12-10-13-17-39)40-18-14-11-15-19-40/h10-21,24-28,42,44H,5,22-23,29-30H2,1-4,6-9H3/t42-/m0/s1
InChIKey DJXJLBDMQCKNLO-WBCKFURZSA-N
Mol Weight 724.0 g/mol
Molecular Formula C43H53NO5SSi
Exact Mass 723.341372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBki3GaxlR
Name (1S)-1-[5-(tert-Butyldiphenylsilyl)oxymethyl]2-(p-toluenesulfonyl)aminophenylmethyl]-5,6-dimethyl-2-methylene-5-heptenyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C43H53NO5SSi
InChI InChI=1S/C43H53NO5SSi/c1-31(2)33(4)22-23-34(5)42(49-35(6)45)29-37-28-36(24-27-41(37)44-50(46,47)38-25-20-32(3)21-26-38)30-48-51(43(7,8)9,39-16-12-10-13-17-39)40-18-14-11-15-19-40/h10-21,24-28,42,44H,5,22-23,29-30H2,1-4,6-9H3/t42-/m0/s1
InChIKey DJXJLBDMQCKNLO-WBCKFURZSA-N
Molecular Weight 724.044 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)c1c(C[C@@](C(CCC(=C(C)C)C)=C)(OC(=O)C)[H])cc(CO[Si](C(C)(C)C)(c2ccccc2)c2ccccc2)cc1
SPLASH splash10-0a4j-1920500000-821dcfb9fa6aa53c4adc
Source of Spectrum F-52-10644-30
Synonyms (1S)-1-(5-({[tert-butyl(diphenyl)silyl]oxy}methyl)-2-{[(4-methylphenyl)sulfonyl]amino}benzyl)-5,6-dimethyl-2-methylene-5-heptenyl acetate
Wiley ID 798163