SpectraBase Spectrum ID |
F1ZVQvC7aC2 |
Name |
Methyl 3'-cyano-4'-(4"-nitrophenyl)-spiro[adamantane-2,2'-thiolane]-3'-carboxylate |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H24N2O4S |
InChI |
InChI=1S/C22H24N2O4S/c1-28-20(25)21(12-23)19(15-2-4-18(5-3-15)24(26)27)11-29-22(21)16-7-13-6-14(9-16)10-17(22)8-13/h2-5,13-14,16-17,19H,6-11H2,1H3/t13-,14+,16-,17+,19?,21?,22? |
InChIKey |
ZJDVXWNGQUIKHI-UHFFFAOYSA-N |
Molecular Weight |
412.504 g/mol |
SMILES |
C1(C2(SCC1c1ccc(N(=O)=O)cc1)[C@]1(C[C@]3(C[C@@]2(C[C@](C3)(C1)[H])[H])[H])[H])(C(=O)OC)C#N |
SPLASH |
splash10-001i-1900100000-daa7083bccb556851e4c |
Source of Spectrum |
Y-36-967-47 |
Synonyms |
Methyl 3'-cyano-4'-(p-nitrophenyl)-spiro[adamantane-2,2'-thiolane]-3'-carboxylate
Methyl 3'-cyano-4'-(4-nitrophenyl)spiro[adamantane-2,2'-thiolane]-3'-carboxylate |
Wiley ID |
762473 |