| SpectraBase Compound ID | 2an4fZunLAi |
|---|---|
| InChI | InChI=1S/C16H16N2O5/c1-10(2)12-6-11(3)7-14(8-12)23-16-5-4-13(17(19)20)9-15(16)18(21)22/h4-10H,1-3H3 |
| InChIKey | JSKXLXSIVOCREW-UHFFFAOYSA-N |
| Mol Weight | 316.31 g/mol |
| Molecular Formula | C16H16N2O5 |
| Exact Mass | 316.105922 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 | Kz6gJeqYma1 |
|---|---|
| Name | Promecarb 2,4-dinitrophenylether |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 316.105921618 u |
| Formula | C16H16N2O5 |
| InChI | InChI=1S/C16H16N2O5/c1-10(2)12-6-11(3)7-14(8-12)23-16-5-4-13(17(19)20)9-15(16)18(21)22/h4-10H,1-3H3 |
| InChIKey | JSKXLXSIVOCREW-UHFFFAOYSA-N |
| Molecular Weight | 316.313 g/mol |
| SMILES | C1(N(=O)=O)=CC(N(=O)=O)=CC=C1OC=1C=C(C(C)C)C=C(C1)C |