![[Dimethylcarbamoyl]methyl methyl but-2-ynedioate](/api/spectrum/FlyOPe45OLM/structure.png?h=300&w=458 "[Dimethylcarbamoyl]methyl methyl but-2-ynedioate")
| SpectraBase Compound ID | HpYzBoUNyKY |
|---|---|
| InChI | InChI=1S/C9H11NO5/c1-10(2)7(11)6-15-9(13)5-4-8(12)14-3/h6H2,1-3H3 |
| InChIKey | CJKJUNWJXGISEQ-UHFFFAOYSA-N |
| Mol Weight | 213.19 g/mol |
| Molecular Formula | C9H11NO5 |
| Exact Mass | 213.063722 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | FlyOPe45OLM |
|---|---|
| Name | [Dimethylcarbamoyl]methyl methyl but-2-ynedioate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 213.063722453 u |
| Formula | C9H11NO5 |
| InChI | InChI=1S/C9H11NO5/c1-10(2)7(11)6-15-9(13)5-4-8(12)14-3/h6H2,1-3H3 |
| InChIKey | CJKJUNWJXGISEQ-UHFFFAOYSA-N |
| Molecular Weight | 213.189 g/mol |
| SMILES | C(#CC(=O)OC)C(OCC(N(C)C)=O)=O |