| SpectraBase Spectrum ID |
HcXXIbSCMbo |
| Name |
1-Methyl-3-(phenylthio)-9-oxobicyclo[3.3.1]non-2-ene and 1-Methyl-3-(phenylthio)-9-oxobicyclo[3.3.1]non-3-ene |
| Alternate Name(s) |
1-Methyl-3-(phenylsulfanyl)bicyclo[3.3.1]non-2-en-9-one |
| CAS Registry Number |
90838-33-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18OS |
| InChI |
InChI=1S/C16H18OS/c1-16-9-5-6-12(15(16)17)10-14(11-16)18-13-7-3-2-4-8-13/h2-4,7-8,11-12H,5-6,9-10H2,1H3 |
| InChIKey |
GGCWAZQWZCUOHF-UHFFFAOYSA-N |
| Molecular Weight |
258.379 g/mol |
| SMILES |
C12(C(C(CC(=C2)Sc2ccccc2)CCC1)=O)C |
| SPLASH |
splash10-08fr-0940000000-8922ef29e97a89e5cf26 |
| Source of Spectrum |
J-49-3137-0 |
| Wiley ID |
103362 |
![1-Methyl-3-(phenylthio)-9-oxobicyclo[3.3.1]non-2-ene and 1-Methyl-3-(phenylthio)-9-oxobicyclo[3.3.1]non-3-ene](/api/spectrum/HcXXIbSCMbo/structure.png?h=300&w=458 "1-Methyl-3-(phenylthio)-9-oxobicyclo[3.3.1]non-2-ene and 1-Methyl-3-(phenylthio)-9-oxobicyclo[3.3.1]non-3-ene")
