![p-[bis(2-chloroethyl)amino]-alpha-cyanocinnamic acid, ethyl ester](/api/spectrum/HpDAHCOy3EP/structure.png?h=300&w=458 "p-[bis(2-chloroethyl)amino]-alpha-cyanocinnamic acid, ethyl ester")
| SpectraBase Compound ID | IJIDmJDpyGa |
|---|---|
| InChI | InChI=1S/C16H18Cl2N2O2/c1-2-22-16(21)14(12-19)11-13-3-5-15(6-4-13)20(9-7-17)10-8-18/h3-6,11H,2,7-10H2,1H3 |
| InChIKey | YLTGBFUWBSXITC-UHFFFAOYSA-N |
| Mol Weight | 341.24 g/mol |
| Molecular Formula | C16H18Cl2N2O2 |
| Exact Mass | 340.074533 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | HpDAHCOy3EP |
|---|---|
| Name | p-[bis(2-chloroethyl)amino]-alpha-cyanocinnamic acid, ethyl ester |
| Source of Sample | F. Popp, University of Miami, Coral Gables, Florida |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H18Cl2N2O2 |
| InChI | InChI=1S/C16H18Cl2N2O2/c1-2-22-16(21)14(12-19)11-13-3-5-15(6-4-13)20(9-7-17)10-8-18/h3-6,11H,2,7-10H2,1H3 |
| InChIKey | YLTGBFUWBSXITC-UHFFFAOYSA-N |
| Instrument Name | Varian A-60 |
| Sadtler NMR Number | 4105M |
| Solvent | CDCl3 |