| SpectraBase Spectrum ID |
N09rkDPLBT |
| Name |
Benzamide, 3-chloro-2-fluoro-N-butyl-N-dodecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
397.254770677 u |
| Formula |
C23H37ClFNO |
| InChI |
InChI=1S/C23H37ClFNO/c1-3-5-7-8-9-10-11-12-13-14-19-26(18-6-4-2)23(27)20-16-15-17-21(24)22(20)25/h15-17H,3-14,18-19H2,1-2H3 |
| InChIKey |
YIBXSLATRGMPPQ-UHFFFAOYSA-N |
| Molecular Weight |
398.006 g/mol |
| SMILES |
C1=CC=C(C(=C1Cl)F)C(N(CCCC)CCCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.879718 |
