SpectraBase Spectrum ID |
A2scSZ3fJpU |
Name |
Benzamide, 2-bromo-N-(2-butyl)-N-tetradecyl- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
451.244977975 u |
Formula |
C25H42BrNO |
InChI |
InChI=1S/C25H42BrNO/c1-4-6-7-8-9-10-11-12-13-14-15-18-21-27(22(3)5-2)25(28)23-19-16-17-20-24(23)26/h16-17,19-20,22H,4-15,18,21H2,1-3H3 |
InChIKey |
AFVBFWYBZBWTQM-UHFFFAOYSA-N |
Molecular Weight |
452.521 g/mol |
SMILES |
C(=O)(N(CCCCCCCCCCCCCC)C(CC)C)C=1C(Br)=CC=CC1 |