| SpectraBase Spectrum ID |
FdqR0S7rf8w |
| Name |
2-Thiepinmethanol, .alpha.-(3,4-dimethoxyphenyl)-4,5,6,7-tetrahydro-, 1-oxide, (R*,R*)- |
| CAS Registry Number |
79575-12-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H20O4S |
| InChI |
InChI=1S/C15H20O4S/c1-18-12-8-7-11(10-13(12)19-2)15(16)14-6-4-3-5-9-20(14)17/h6-8,10,15-16H,3-5,9H2,1-2H3/t15-,20?/m1/s1 |
| InChIKey |
ZKVYNLBFLWMZDK-IWPPFLRJSA-N |
| Molecular Weight |
296.381 g/mol |
| SMILES |
O[C@@](C=1[S@](=O)CCCCC1)(c1cc(OC)c(cc1)OC)[H] |
| SPLASH |
splash10-0hk9-0590000000-62c193fd03b84b480b66 |
| Source of Spectrum |
B-34-1034-0 |
| Synonyms |
(R)-(3,4-dimethoxyphenyl)(1-oxido-4,5,6,7-tetrahydro-2-thiepinyl)methanol
2-[1-hydroxy-1-(3,4-dimethoxyphenyl)methyl]-1-thiacyclohept-2-ene 1-oxide |
| Wiley ID |
1298847 |
