| SpectraBase Spectrum ID |
JPRvNJ3o4o9 |
| Name |
Butanedioic acid, [(3,4-dimethoxyphenyl)methyl]-, 1-(cyanomethyl)4-methyl ester, (.+-.)- |
| CAS Registry Number |
126673-07-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19NO6 |
| InChI |
InChI=1S/C16H19NO6/c1-20-13-5-4-11(9-14(13)21-2)8-12(10-15(18)22-3)16(19)23-7-6-17/h4-5,9,12H,7-8,10H2,1-3H3 |
| InChIKey |
JQLIEXLOVXJIED-UHFFFAOYSA-N |
| Molecular Weight |
321.329 g/mol |
| SMILES |
C(C(CC(=O)OC)Cc1cc(OC)c(cc1)OC)(=O)OCC#N |
| SPLASH |
splash10-0006-3970000000-9d030984cd4ca2cbe036 |
| Source of Spectrum |
F-45-5057-8 |
| Synonyms |
1-(cyanomethyl) 4-methyl 2-(3,4-dimethoxybenzyl)succinate
racemic 1-cyanomethyl4-methyl 2-(3,4-dimethoxybenzyl)suocinate |
| Wiley ID |
1320844 |
![Butanedioic acid, [(3,4-dimethoxyphenyl)methyl]-, 1-(cyanomethyl)4-methyl ester, (.+-.)-](/api/spectrum/JPRvNJ3o4o9/structure.png?h=300&w=458 "Butanedioic acid, [(3,4-dimethoxyphenyl)methyl]-, 1-(cyanomethyl)4-methyl ester, (.+-.)-")
