| SpectraBase Spectrum ID |
5stqqvDqNwS |
| Name |
2-Thiepinmethanol, 4,5,6,7-tetrahydro-.alpha.-(4-nitrophenyl)-, 1-oxide, (R*,R*)- |
| Alternate Name(s) |
(4-nitrophenyl)(1-oxido-4,5,6,7-tetrahydro-2-thiepinyl)methanol
2-(1-Hydroxy-1-p-nitrophenylmethyl)-1-thiacyclohept-2-ene 1-oxide |
| CAS Registry Number |
79575-19-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H15NO4S |
| InChI |
InChI=1S/C13H15NO4S/c15-13(12-4-2-1-3-9-19(12)18)10-5-7-11(8-6-10)14(16)17/h4-8,13,15H,1-3,9H2 |
| InChIKey |
GAAOVDLVQIZZPC-UHFFFAOYSA-N |
| Molecular Weight |
281.326 g/mol |
| SMILES |
OC(C=1S(=O)CCCCC1)c1ccc(N(=O)=O)cc1 |
| SPLASH |
splash10-0ik9-0490000000-ce532cb9eccb493601a3 |
| Source of Spectrum |
B-34-1035-0 |
| Wiley ID |
1284705 |
