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4-(4-Chlorophenyl)-1',7',7'-trimethyl-spiro[1,3,4-thiadiazole-5,2'-norbornane]-2-carboxylic acid ethyl ester
SpectraBase Compound ID LaDAykyZWkW
InChI InChI=1S/C20H25ClN2O2S/c1-5-25-17(24)16-22-23(15-8-6-14(21)7-9-15)20(26-16)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 KFXGGGXSPNBTLT-NXAXYOPQSA-N
Mol Weight 392.95 g/mol
Molecular Formula C20H25ClN2O2S
Exact Mass 392.132527 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LhBf9vmy4BF
Name 4-(4-Chlorophenyl)-1',7',7'-trimethyl-spiro[1,3,4-thiadiazole-5,2'-norbornane]-2-carboxylic acid ethyl ester
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Formula C20H25ClN2O2S
InChI InChI=1S/C20H25ClN2O2S/c1-5-25-17(24)16-22-23(15-8-6-14(21)7-9-15)20(26-16)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 KFXGGGXSPNBTLT-NXAXYOPQSA-N
Molecular Weight 392.945 g/mol
SMILES C=1(SC2(N(N1)c1ccc(cc1)Cl)C[C@@]1(CC[C@]2(C1(C)C)C)[H])C(=O)OCC
SPLASH splash10-0002-9104000000-ab3684eb0525a97d9431
Source of Spectrum AJ-41-734-7
Synonyms 4-(4-Chlorophenyl)-4',7',7'-trimethyl-2-spiro[1,3,4-thiadiazole-5,3'-bicyclo[2.2.1]heptane]carboxylic acid ethyl ester Ethyl 4-(4-chlorophenyl)-1',7',7'-trimethyl-spiro[1,3,4-thiadiazole-5,2'-norbornane]-2-carboxylate Ethyl 4-(4-chlorophenyl)-4',7',7'-trimethyl-spiro[1,3,4-thiadiazole-5,3'-bicyclo[2.2.1]heptane]-2-carboxylate
Wiley ID 1567668