| SpectraBase Spectrum ID |
I1jCKPh14tV |
| Name |
8a-(benzenesulfonyl)-5,8-dihydro-4aH-naphthalene-1,4-dione |
| Alternate Name(s) |
8a-(phenylsulfonyl)-5,8-dihydro-4aH-naphthalene-1,4-dione
8a-besyl-5,8-dihydro-4aH-naphthalene-1,4-quinone |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H14O4S |
| InChI |
InChI=1S/C16H14O4S/c17-14-9-10-15(18)16(11-5-4-8-13(14)16)21(19,20)12-6-2-1-3-7-12/h1-7,9-10,13H,8,11H2/t13?,16-/m0/s1 |
| InChIKey |
ZUUXYUQSYSJYCL-VYIIXAMBSA-N |
| Molecular Weight |
302.344 g/mol |
| SMILES |
[C@@]12(S(=O)(=O)c3ccccc3)C(C(=O)C=CC1=O)CC=CC2 |
| SPLASH |
splash10-004i-9002000000-1b039db0b25e24c085b0 |
| Source of Spectrum |
KC-1992-2883-12 |
| Wiley ID |
777075 |
