| SpectraBase Spectrum ID |
HjS86UK9qBF |
| Name |
3-Carbethoxy-4-(4-chloro-2,5-dimethoxyphenyl)-2-methyl-3-butenoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19ClO6 |
| InChI |
InChI=1S/C16H19ClO6/c1-5-23-16(20)11(9(2)15(18)19)6-10-7-14(22-4)12(17)8-13(10)21-3/h6-9H,5H2,1-4H3,(H,18,19)/b11-6- |
| InChIKey |
AHKXMHDAGDPIQL-WDZFZDKYSA-N |
| Molecular Weight |
342.775 g/mol |
| SMILES |
OC(C(\C(=C\c1c(cc(c(c1)OC)Cl)OC)C(=O)OCC)C)=O |
| SPLASH |
splash10-0a4i-0093000000-6561f18a68b24b5f6251 |
| Source of Spectrum |
J-58-7909-3 |
| Synonyms |
(3Z)-4-(4-chloro-2,5-dimethoxyphenyl)-3-(ethoxycarbonyl)-2-methyl-3-butenoic acid |
| Wiley ID |
1336324 |
