| SpectraBase Spectrum ID |
GILDYoUt2Wh |
| Name |
2H-1,4-Benzoxazin-3(4H)-one, 4-[(2-chloro-4-fluorophenyl)methyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
291.046234459 u |
| Formula |
C15H11ClFNO2 |
| InChI |
InChI=1S/C15H11ClFNO2/c16-12-7-11(17)6-5-10(12)8-18-13-3-1-2-4-14(13)20-9-15(18)19/h1-7H,8-9H2 |
| InChIKey |
URYKYHHKFNYYKR-UHFFFAOYSA-N |
| Molecular Weight |
291.709 g/mol |
| SMILES |
C1=CC=C2C(=C1)OCC(N2CC=1C(=CC(=CC1)F)Cl)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92374 |
![2H-1,4-Benzoxazin-3(4H)-one, 4-[(2-chloro-4-fluorophenyl)methyl]-](/api/spectrum/GILDYoUt2Wh/structure.png?h=300&w=458 "2H-1,4-Benzoxazin-3(4H)-one, 4-[(2-chloro-4-fluorophenyl)methyl]-")
