| SpectraBase Spectrum ID |
EToTcoLZZFS |
| Name |
Furo[3,4-B]pyridine-2,5(1H,3H)-dione, 4,7-dihydro-1-(3-methylphenyl)-4-(3-nitrophenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
364.105921618 u |
| Formula |
C20H16N2O5 |
| InChI |
InChI=1S/C20H16N2O5/c1-12-4-2-6-14(8-12)21-17-11-27-20(24)19(17)16(10-18(21)23)13-5-3-7-15(9-13)22(25)26/h2-9,16H,10-11H2,1H3 |
| InChIKey |
AADBPSGKIHBFFM-UHFFFAOYSA-N |
| Molecular Weight |
364.357 g/mol |
| SMILES |
CC=1C=CC=C(C1)N1C2=C(C(CC1=O)C=1C=CC=C(C1)N(=O)=O)C(=O)OC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.806749 |
![Furo[3,4-b]pyridine-2,5(1H,3H)-dione, 4,7-dihydro-1-(3-methylphenyl)-4-(3-nitrophenyl)-](/api/spectrum/EToTcoLZZFS/structure.png?h=300&w=458 "Furo[3,4-b]pyridine-2,5(1H,3H)-dione, 4,7-dihydro-1-(3-methylphenyl)-4-(3-nitrophenyl)-")
