| SpectraBase Spectrum ID |
GZ8EJ2VUE0V |
| Name |
Benzamide, 3-chloro-2-fluoro-N-(2-butyl)-N-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
243.082619969 u |
| Formula |
C12H15ClFNO |
| InChI |
InChI=1S/C12H15ClFNO/c1-4-8(2)15(3)12(16)9-6-5-7-10(13)11(9)14/h5-8H,4H2,1-3H3 |
| InChIKey |
NXTGZPGZOAQEMW-UHFFFAOYSA-N |
| Molecular Weight |
243.709 g/mol |
| SMILES |
CN(C(CC)C)C(=O)C=1C(F)=C(C=CC1)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.885066 |
