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anti-(2RS,3RS)-7-[N-(p-Nitrophenyl)amido]-9-methyl-10-phenylthio-7-azaspiro[5.4]decane
SpectraBase Compound ID FwSmqM42cnW
InChI InChI=1S/C23H27N3O3S/c1-17-16-25(22(27)24-18-10-12-19(13-11-18)26(28)29)23(14-6-3-7-15-23)21(17)30-20-8-4-2-5-9-20/h2,4-5,8-13,17,21H,3,6-7,14-16H2,1H3,(H,24,27)/t17-,21+/m1/s1
InChIKey VHUYJIHHMNSRJV-UTKZUKDTSA-N
Mol Weight 425.55 g/mol
Molecular Formula C23H27N3O3S
Exact Mass 425.177313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C9FhMVUESve
Name anti-(2RS,3RS)-7-[N-(p-Nitrophenyl)amido]-9-methyl-10-phenylthio-7-azaspiro[5.4]decane
Alternate Name(s) (3R,4S)-3-methyl-N-(4-nitrophenyl)-4-(phenylsulfanyl)-1-azaspiro[4.5]decane-1-carboxamide anti-(9RS,10RS)-7-[N-(p-Nitrophenyl)amido]-9-methyl-10-phenylthio-7-azaspiro[5.4]decane
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Formula C23H27N3O3S
InChI InChI=1S/C23H27N3O3S/c1-17-16-25(22(27)24-18-10-12-19(13-11-18)26(28)29)23(14-6-3-7-15-23)21(17)30-20-8-4-2-5-9-20/h2,4-5,8-13,17,21H,3,6-7,14-16H2,1H3,(H,24,27)/t17-,21+/m1/s1
InChIKey VHUYJIHHMNSRJV-UTKZUKDTSA-N
Molecular Weight 425.547 g/mol
SMILES N(C(N1C2([C@@](Sc3ccccc3)([C@@](C1)(C)[H])[H])CCCCC2)=O)c1ccc(N(=O)=O)cc1
SPLASH splash10-03di-0900000000-1a5a408a981b4070b187
Source of Spectrum KC-1993-1649-35
Wiley ID 778327