| SpectraBase Spectrum ID |
1w94h0ar4JH |
| Name |
(4aS,5R,8S,8aR)-4a,5,8,8a-Tetrahydro-2,3-bisphenylsulfonyl-5,8-methano-1,4-naphthoquinone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H18O6S2 |
| InChI |
InChI=1S/C23H18O6S2/c24-20-18-14-11-12-15(13-14)19(18)21(25)23(31(28,29)17-9-5-2-6-10-17)22(20)30(26,27)16-7-3-1-4-8-16/h1-12,14-15,18-19H,13H2/t14-,15+,18-,19+ |
| InChIKey |
HBFQXOLSOUAYKR-FDCRZUCXSA-N |
| Molecular Weight |
454.511 g/mol |
| SMILES |
C1(=C(S(=O)(=O)c2ccccc2)C(=O)[C@@]2([C@](C1=O)([C@@]1(C=C[C@]2(C1)[H])[H])[H])[H])S(=O)(=O)c1ccccc1 |
| SPLASH |
splash10-0udi-9000000000-bbe06750c7aecd46340e |
| Source of Spectrum |
KC-1992-2883-13 |
| Synonyms |
(1R,2S,7R,8S)-4,5-bis(phenylsulfonyl)tricyclo[6.2.1.0(2,7)]undeca-4,9-diene-3,6-dione
4a,5,8,8a-Tetrahydro-2,3-bisphenylsulfonyl-5,8-methano-1,4-naphthoquinone |
| Wiley ID |
777073 |
