| SpectraBase Compound ID | GhShDWDmul6 |
|---|---|
| InChI | InChI=1S/C12H10N2O3/c1-13-7-6-9(8-13)12(15)10-4-2-3-5-11(10)14(16)17/h2-8H,1H3 |
| InChIKey | ANLUGRKIJNFYMJ-UHFFFAOYSA-N |
| Mol Weight | 230.22 g/mol |
| Molecular Formula | C12H10N2O3 |
| Exact Mass | 230.069142 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 | H0QncWuuOAe |
|---|---|
| Name | (2-Nitrophenyl)(1-methyl-1H-pyrrol-3-yl)methanone |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 230.069142187 u |
| Formula | C12H10N2O3 |
| InChI | InChI=1S/C12H10N2O3/c1-13-7-6-9(8-13)12(15)10-4-2-3-5-11(10)14(16)17/h2-8H,1H3 |
| InChIKey | ANLUGRKIJNFYMJ-UHFFFAOYSA-N |
| Molecular Weight | 230.223 g/mol |
| SMILES | C1(C(C=2C(N(=O)=O)=CC=CC2)=O)=CN(C)C=C1 |