SpectraBase Spectrum ID |
FCFoWwQhuYe |
Name |
Benzenamine, 4-bromo-N,N-diethyl-3,5-dimethyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
255.062262584 u |
Formula |
C12H18BrN |
InChI |
InChI=1S/C12H18BrN/c1-5-14(6-2)11-7-9(3)12(13)10(4)8-11/h7-8H,5-6H2,1-4H3 |
InChIKey |
HQHBBJBTYYERKR-UHFFFAOYSA-N |
Molecular Weight |
256.187 g/mol |
SMILES |
CCN(CC)C1=CC(C)=C(C(=C1)C)Br |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.944288 |