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1',7',7'-trimethyl-4-(4-nitrophenyl)spiro[1,3,4-thiadiazole-5,2'-norbornane]-2-carboxylic acid ethyl ester
SpectraBase Compound ID FntshrTrmvH
InChI InChI=1S/C20H25N3O4S/c1-5-27-17(24)16-21-22(14-6-8-15(9-7-14)23(25)26)20(28-16)12-13-10-11-19(20,4)18(13,2)3/h6-9,13H,5,10-12H2,1-4H3/t13-,19-,20?/m0/s1
InChIKey XEBFRMKMLQQHDF-UHFFFAOYSA-N
Mol Weight 403.5 g/mol
Molecular Formula C20H25N3O4S
Exact Mass 403.156577 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9sBMfIxlQcn
Name 1',7',7'-trimethyl-4-(4-nitrophenyl)spiro[1,3,4-thiadiazole-5,2'-norbornane]-2-carboxylic acid ethyl ester
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Formula C20H25N3O4S
InChI InChI=1S/C20H25N3O4S/c1-5-27-17(24)16-21-22(14-6-8-15(9-7-14)23(25)26)20(28-16)12-13-10-11-19(20,4)18(13,2)3/h6-9,13H,5,10-12H2,1-4H3/t13-,19-,20?/m0/s1
InChIKey XEBFRMKMLQQHDF-UHFFFAOYSA-N
Molecular Weight 403.497 g/mol
SMILES C=1(SC2(N(N1)c1ccc(cc1)N(=O)=O)C[C@@]1(CC[C@]2(C1(C)C)C)[H])C(=O)OCC
SPLASH splash10-0a4i-7900000000-f16d02c78189d4c64d44
Source of Spectrum AJ-41-733-6
Synonyms 4',7',7'-trimethyl-4-(4-nitrophenyl)-2-spiro[1,3,4-thiadiazole-5,3'-bicyclo[2.2.1]heptane]carboxylic acid ethyl ester Ethyl 1',7',7'-trimethyl-4-(4-nitrophenyl)spiro[1,3,4-thiadiazole-5,2'-norbornane]-2-carboxylate Ethyl 4',7',7'-trimethyl-4-(4-nitrophenyl)spiro[1,3,4-thiadiazole-5,3'-bicyclo[2.2.1]heptane]-2-carboxylate
Wiley ID 1567669