| SpectraBase Spectrum ID |
3QoI7lpH87j |
| Name |
2-Thiepinmethanol, 4,5,6,7-tetrahydro-.alpha.-(4-methylphenyl)-, 1-oxide, (R*,R*)- |
| CAS Registry Number |
79575-17-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18O2S |
| InChI |
InChI=1S/C14H18O2S/c1-11-6-8-12(9-7-11)14(15)13-5-3-2-4-10-17(13)16/h5-9,14-15H,2-4,10H2,1H3 |
| InChIKey |
FCNQWOVNVKWDPK-UHFFFAOYSA-N |
| Molecular Weight |
250.356 g/mol |
| SMILES |
OC(C=1S(=O)CCCCC1)c1ccc(cc1)C |
| SPLASH |
splash10-00lr-0590000000-a40579a5b933c33cb4d1 |
| Source of Spectrum |
B-34-1035-0 |
| Synonyms |
(4-methylphenyl)(1-oxido-4,5,6,7-tetrahydro-2-thiepinyl)methanol
2-(1-Hydroxy-1-p-tolylmethyl)-1-thiacyclohept-2-ene 1-oxide |
| Wiley ID |
1253209 |
