| SpectraBase Spectrum ID |
CfPn2JIpCbL |
| Name |
Butanedioic acid, [(3,4-dimethoxyphenyl)methyl]-, 4-(cyanomethyl)1-methyl ester, (.+-.)- |
| CAS Registry Number |
126672-99-9 |
| 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(16(19)22-3)10-15(18)23-7-6-17/h4-5,9,12H,7-8,10H2,1-3H3 |
| InChIKey |
DLIFGDXTPDURFP-UHFFFAOYSA-N |
| Molecular Weight |
321.329 g/mol |
| SMILES |
C(C(CC(=O)OCC#N)Cc1cc(OC)c(cc1)OC)(=O)OC |
| SPLASH |
splash10-0udi-0901000000-25faa3ba0bbbc1f85761 |
| Source of Spectrum |
F-45-5055-4 |
| Synonyms |
4-(cyanomethyl) 1-methyl 2-(3,4-dimethoxybenzyl)succinate
racemic 4-cyanomethyl 1-methyl 2-(3,4-dimethoxybenzyl)suocinate |
| Wiley ID |
1320843 |
![Butanedioic acid, [(3,4-dimethoxyphenyl)methyl]-, 4-(cyanomethyl)1-methyl ester, (.+-.)-](/api/spectrum/CfPn2JIpCbL/structure.png?h=300&w=458 "Butanedioic acid, [(3,4-dimethoxyphenyl)methyl]-, 4-(cyanomethyl)1-methyl ester, (.+-.)-")
