| SpectraBase Spectrum ID |
GwIEe1w0Bnf |
| Name |
(3aS,6S,7aR,Rs)-2-Methyl-6-(p-tolylsulfinyl)perhydroisoindole-1,3,5-trione |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H17NO4S |
| InChI |
InChI=1S/C16H17NO4S/c1-9-3-5-10(6-4-9)22(21)14-8-12-11(7-13(14)18)15(19)17(2)16(12)20/h3-6,11-12,14H,7-8H2,1-2H3/t11-,12+,14-,22?/m0/s1 |
| InChIKey |
QHWINDVALKOYEL-QDQYXVEOSA-N |
| Molecular Weight |
319.375 g/mol |
| SMILES |
C1(N(C([C@]2(CC([C@](C[C@@]12[H])([S@@](c1ccc(cc1)C)=O)[H])=O)[H])=O)C)=O |
| SPLASH |
splash10-014l-9600000000-472397dd76fb040e66cf |
| Source of Spectrum |
QC-11-1225-18 |
| Synonyms |
(3aS,6S,7aR)-2-methyl-6-[(4-methylphenyl)sulfinyl]tetrahydro-1H-isoindole-1,3,5(2H,4H)-trione |
| Wiley ID |
859683 |
