| SpectraBase Spectrum ID |
68PxjuefrsU |
| Name |
4-Bromo-2-methylnaphthalen-1-amine, N-methyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
249.015312390 u |
| Formula |
C12H12BrN |
| InChI |
InChI=1S/C12H12BrN/c1-8-7-11(13)9-5-3-4-6-10(9)12(8)14-2/h3-7,14H,1-2H3 |
| InChIKey |
MDLKOYOYPSZEMJ-UHFFFAOYSA-N |
| Molecular Weight |
250.139 g/mol |
| SMILES |
C1(Br)=C2C(=C(C(=C1)C)NC)C=CC=C2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90269 |
