| SpectraBase Spectrum ID |
3TP1b4CcVcF |
| Name |
(2R,4aS,7R,8aR)-(-)-2-(3'-Hydroxy-4'-methoxyphenyl)-9,9-dimethyltetrahydro-5H-4a,7-methano-4H-1,3-benzoxathiane |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H24O3S |
| InChI |
InChI=1S/C18H24O3S/c1-17(2)12-6-7-18(17)10-22-16(21-15(18)9-12)11-4-5-14(20-3)13(19)8-11/h4-5,8,12,15-16,19H,6-7,9-10H2,1-3H3/t12-,15-,16+,18+/m1/s1 |
| InChIKey |
IFPUUQMSZGAYIM-ANRZDRKOSA-N |
| Molecular Weight |
320.447 g/mol |
| SMILES |
Oc1cc([C@@]2(SC[C@]34[C@](O2)(C[C@](C4(C)C)(CC3)[H])[H])[H])ccc1OC |
| SPLASH |
splash10-0udi-0901000000-6978e081a652c0b3c144 |
| Source of Spectrum |
QC-11-3185-9 |
| Wiley ID |
859988 |
