| SpectraBase Spectrum ID |
6mzcVb0rob8 |
| Name |
5-(Ethoxycarbonyl)-3-methoxy-7-(phenylthio)cyclohepta-2,4,6-trien-1-one |
| Alternate Name(s) |
Ethyl 3-methoxy-5-oxo-6-(phenylsulfanyl)-1,3,6-cycloheptatriene-1-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H16O4S |
| InChI |
InChI=1S/C17H16O4S/c1-3-21-17(19)12-9-13(20-2)11-15(18)16(10-12)22-14-7-5-4-6-8-14/h4-11H,3H2,1-2H3 |
| InChIKey |
JYSRZJLFLOEJGX-UHFFFAOYSA-N |
| Molecular Weight |
316.371 g/mol |
| SMILES |
C=1(C=C(C(=O)C=C(C1)OC)Sc1ccccc1)C(=O)OCC |
| SPLASH |
splash10-014r-1295000000-35488a34c626b6a81186 |
| Source of Spectrum |
F-50-9891-9 |
| Wiley ID |
1316648 |
