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(4R,5R)-4-(4-chlorophenyl)-2-keto-5-phenoxycarbothioyloxy-piperidine-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID FG20DWlVsml
InChI InChI=1S/C23H24ClNO5S/c1-23(2,3)30-21(27)25-14-19(29-22(31)28-17-7-5-4-6-8-17)18(13-20(25)26)15-9-11-16(24)12-10-15/h4-12,18-19H,13-14H2,1-3H3/t18-,19+/m1/s1
InChIKey OXCUJTYYMJWAHS-MOPGFXCFSA-N
Mol Weight 461.96 g/mol
Molecular Formula C23H24ClNO5S
Exact Mass 461.106372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1T62Xt1h6l9
Name (4R,5R)-4-(4-chlorophenyl)-2-keto-5-phenoxycarbothioyloxy-piperidine-1-carboxylic acid tert-butyl ester
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Formula C23H24ClNO5S
InChI InChI=1S/C23H24ClNO5S/c1-23(2,3)30-21(27)25-14-19(29-22(31)28-17-7-5-4-6-8-17)18(13-20(25)26)15-9-11-16(24)12-10-15/h4-12,18-19H,13-14H2,1-3H3/t18-,19+/m1/s1
InChIKey OXCUJTYYMJWAHS-MOPGFXCFSA-N
Molecular Weight 461.960 g/mol
SMILES C(N1C(C[C@@]([C@](C1)(OC(=S)Oc1ccccc1)[H])(c1ccc(cc1)Cl)[H])=O)(OC(C)(C)C)=O
SPLASH splash10-0q2c-9530000000-135b9c0045660034a879
Source of Spectrum F2-42-2058-19
Synonyms (4R,5R)-4-(4-chlorophenyl)-2-oxo-5-[phenoxy(sulfanylidene)methoxy]-1-piperidinecarboxylic acid tert-butyl ester tert-Butyl (4R,5R)-4-(4-chlorophenyl)-2-oxidanylidene-5-phenoxycarbothioyloxy-piperidine-1-carboxylate tert-Butyl (4R,5R)-4-(4-chlorophenyl)-2-oxo-5-phenoxycarbothioyloxy-piperidine-1-carboxylate
Wiley ID 1600162