| SpectraBase Compound ID | AGTesmarMw1 |
|---|---|
| InChI | InChI=1S/C10H16O4/c1-4-5-8(6-9(11)13-2)7-10(12)14-3/h4-5,8H,6-7H2,1-3H3/b5-4+ |
| InChIKey | FIFUYJFORPJPDQ-SNAWJCMRSA-N |
| Mol Weight | 200.23 g/mol |
| Molecular Formula | C10H16O4 |
| Exact Mass | 200.104859 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 | FOFIb78RmeB |
|---|---|
| Name | Pentanedioic acid, 3-(1E)-1-propen-1-yl-, dimethyl ester |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 200.104858991 u |
| Formula | C10H16O4 |
| InChI | InChI=1S/C10H16O4/c1-4-5-8(6-9(11)13-2)7-10(12)14-3/h4-5,8H,6-7H2,1-3H3/b5-4+ |
| InChIKey | FIFUYJFORPJPDQ-SNAWJCMRSA-N |
| Molecular Weight | 200.234 g/mol |
| SMILES | C(CC(CC(=O)OC)\C=C\C)(=O)OC |