| SpectraBase Spectrum ID |
K0JFJNTjew |
| Name |
Methyl [1-(phenylsulfonyl)-1,3-cyclohexadien-5-yl]acetoacetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H18O5S |
| InChI |
InChI=1S/C17H18O5S/c1-12(18)16(17(19)22-2)13-7-6-10-15(11-13)23(20,21)14-8-4-3-5-9-14/h3-10,13,16H,11H2,1-2H3 |
| InChIKey |
BPJSVNOYOQVIFX-UHFFFAOYSA-N |
| Molecular Weight |
334.386 g/mol |
| SMILES |
C=1(S(=O)(=O)c2ccccc2)CC(C(C(=O)OC)C(=O)C)C=CC1 |
| SPLASH |
splash10-05r3-4592000000-30314849ba2f5baa318c |
| Source of Spectrum |
QA-44-369-8h |
| Synonyms |
Methyl[(3S)1-(phenylsulfonyl)-1,3-cyclohexadien-5-yl]acetoacetate |
| Wiley ID |
862566 |
![Methyl [1-(phenylsulfonyl)-1,3-cyclohexadien-5-yl]acetoacetate](/api/spectrum/K0JFJNTjew/structure.png?h=300&w=458 "Methyl [1-(phenylsulfonyl)-1,3-cyclohexadien-5-yl]acetoacetate")
