| SpectraBase Spectrum ID |
LakKADnpj0c |
| Name |
(4a,1-trans)-8-Chloro-1-methoxy-2,3,4,4a,9,9a-hexahydro-1H-xanthen-7-ol |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H17ClO3 |
| InChI |
InChI=1S/C14H17ClO3/c1-17-11-3-2-4-12-8(11)7-9-13(18-12)6-5-10(16)14(9)15/h5-6,8,11-12,16H,2-4,7H2,1H3/t8-,11-,12+/m0/s1 |
| InChIKey |
WGVMLTPJPLPOPY-KPXOXKRLSA-N |
| Molecular Weight |
268.740 g/mol |
| SMILES |
Oc1c(c2c(O[C@@]3(CCC[C@@]([C@@]3(C2)[H])(OC)[H])[H])cc1)Cl |
| SPLASH |
splash10-066r-0090000000-7dd95cb0defbb959f919 |
| Source of Spectrum |
U1-2009-5584-11 |
| Synonyms |
(8S,8aS,10aR)-1-Chloro-8-methoxy-5,7,8,8a,9,10a-hexahydro-6H-xanthen-2-ol
(8S,8aS,10aR)-1-chloranyl-8-methoxy-6,7,8,8a,9,10a-hexahydro-5H-xanthen-2-ol |
| Wiley ID |
1697308 |
