| SpectraBase Spectrum ID |
ESsHQYz0fs8 |
| Name |
2H-Naphtho[2,3-B]pyran-2,5,10-trione, 4-(3-fluorophenyl)-3,4-dihydro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
322.064136993 u |
| Formula |
C19H11FO4 |
| InChI |
InChI=1S/C19H11FO4/c20-11-5-3-4-10(8-11)14-9-15(21)24-19-16(14)17(22)12-6-1-2-7-13(12)18(19)23/h1-8,14H,9H2 |
| InChIKey |
DQMVOFRGANVPQM-UHFFFAOYSA-N |
| Molecular Weight |
322.291 g/mol |
| SMILES |
C1=C(C=C(C=C1)C1CC(OC2=C1C(C1=C(C2=O)C=CC=C1)=O)=O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.802374 |