| SpectraBase Spectrum ID |
1kDJ7T7uHqJ |
| Name |
Thiocarbaminic acid, N,N-dimethyl-, o-[4-(2-fluorophenylaminocarbonyl)]phenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.083827066 u |
| Formula |
C16H15FN2O2S |
| InChI |
InChI=1S/C16H15FN2O2S/c1-19(2)16(22)21-12-9-7-11(8-10-12)15(20)18-14-6-4-3-5-13(14)17/h3-10H,1-2H3,(H,18,20) |
| InChIKey |
HRSWQNKXGXHFAL-UHFFFAOYSA-N |
| Molecular Weight |
318.366 g/mol |
| SMILES |
C(OC1=CC=C(C(NC2=CC=CC=C2F)=O)C=C1)(=S)N(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.911924 |
![Thiocarbaminic acid, N,N-dimethyl-, o-[4-(2-fluorophenylaminocarbonyl)]phenyl ester](/api/spectrum/1kDJ7T7uHqJ/structure.png?h=300&w=458 "Thiocarbaminic acid, N,N-dimethyl-, o-[4-(2-fluorophenylaminocarbonyl)]phenyl ester")
