| SpectraBase Spectrum ID |
DStXyNnLq79 |
| Name |
3-Bromo-5-chloro-2-methoxyaniline, N,N-diacetyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
318.961083915 u |
| Formula |
C11H11BrClNO3 |
| InChI |
InChI=1S/C11H11BrClNO3/c1-6(15)14(7(2)16)10-5-8(13)4-9(12)11(10)17-3/h4-5H,1-3H3 |
| InChIKey |
PLYDWERMHPTSEW-UHFFFAOYSA-N |
| Molecular Weight |
320.570 g/mol |
| SMILES |
C1(Br)=C(C(=CC(=C1)Cl)N(C(=O)C)C(=O)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.805945 |
