| SpectraBase Spectrum ID |
Ix1UxuABWUD |
| Name |
11-Nitro-noracronycine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| 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 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937048 |
