| SpectraBase Compound ID | HEoR7bblY1d |
|---|---|
| InChI | InChI=1S/C19H16N2O5/c1-19(2)8-7-10-14(26-19)9-13(22)15-17(10)20(3)16-11(18(15)23)5-4-6-12(16)21(24)25/h4-9,22H,1-3H3 |
| InChIKey | FGHCFTMHOSQNGT-UHFFFAOYSA-N |
| Mol Weight | 352.35 g/mol |
| Molecular Formula | C19H16N2O5 |
| Exact Mass | 352.105922 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | JrqfzPMfrkC |
|---|---|
| Name | 11-Nitro-noracronycine |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 352.105921618 u |
| Formula | C19H16N2O5 |
| InChI | InChI=1S/C19H16N2O5/c1-19(2)8-7-10-14(26-19)9-13(22)15-17(10)20(3)16-11(18(15)23)5-4-6-12(16)21(24)25/h4-9,22H,1-3H3 |
| InChIKey | FGHCFTMHOSQNGT-UHFFFAOYSA-N |
| Molecular Weight | 352.346 g/mol |
| SMILES | C12=C(N(C)C=3C(C2=O)=CC=CC3N(=O)=O)C=2C=CC(OC2C=C1O)(C)C |