| SpectraBase Spectrum ID |
8oxvMIgikd9 |
| Name |
Butanamide, 2-[2,5-bis(1,1-dimethylpropyl)phenoxy]-N-(3,5-dichloro-2-hydroxy-4-methylphenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
493.215049452 u |
| Formula |
C27H37Cl2NO3 |
| InChI |
InChI=1S/C27H37Cl2NO3/c1-9-21(25(32)30-20-15-19(28)16(4)23(29)24(20)31)33-22-14-17(26(5,6)10-2)12-13-18(22)27(7,8)11-3/h12-15,21,31H,9-11H2,1-8H3,(H,30,32) |
| InChIKey |
APBMFRVZQMCNKS-UHFFFAOYSA-N |
| Molecular Weight |
494.503 g/mol |
| SMILES |
C(C(=O)NC1=CC(Cl)=C(C(=C1O)Cl)C)(CC)OC1=CC(=CC=C1C(C)(C)CC)C(C)(C)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908627 |