| SpectraBase Spectrum ID |
J627HVcKgC1 |
| Name |
N-(3-Chloro-2-fluorophenyl)-N-methyl-2-phenylbutanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
305.098270033 u |
| Formula |
C17H17ClFNO |
| InChI |
InChI=1S/C17H17ClFNO/c1-3-13(12-8-5-4-6-9-12)17(21)20(2)15-11-7-10-14(18)16(15)19/h4-11,13H,3H2,1-2H3 |
| InChIKey |
SANOQYVMYRBYMR-UHFFFAOYSA-N |
| Molecular Weight |
305.780 g/mol |
| SMILES |
C=1C(=C(C(N(C)C(=O)C(C2=CC=CC=C2)CC)=CC1)F)Cl |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915561 |
