| SpectraBase Spectrum ID |
IRyo9utzBfY |
| Name |
(4aS,9aR)-7-Butylsulfanylmethylene-6-methoxy-4a-methyl-decahydro-benzocyclohepten-5-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H30O2S |
| InChI |
InChI=1S/C18H30O2S/c1-4-5-12-21-13-14-9-10-15-8-6-7-11-18(15,2)17(19)16(14)20-3/h13,15-16H,4-12H2,1-3H3/b14-13+/t15-,16?,18+/m1/s1 |
| InChIKey |
IPAHNEQWFPMAEC-HWOKQJHQSA-N |
| Molecular Weight |
310.496 g/mol |
| SMILES |
C1([C@@]2([C@@](CC\C(C1OC)=C/SCCCC)(CCCC2)[H])C)=O |
| SPLASH |
splash10-03dl-1921000000-43b14fb54f0157cc2903 |
| Source of Spectrum |
AT-31-1876-5 |
| Synonyms |
(1S,7R)-1-Methyl-3-methoxy-4-(n-butylthiomethylene)bicyclo[5.4.0]undecan-2-one
(4aS,7E,9aR)-7-[(butylsulfanyl)methylene]-6-methoxy-4a-methyldecahydro-5H-benzo[a]cyclohepten-5-one
1-Methyl-2-methoxy-3-(n-butylthiomethylene)bicyclo[5.4.0]undecan-2-one |
| Wiley ID |
835703 |
