SpectraBase Spectrum ID |
BRnpQUy7btn |
Name |
1H-Cyclopropa[A]naphthalene, 3-bromo-1,1-dichloro-1A,2,3,7B-tetrahydro- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
289.926468690 u |
Formula |
C11H9BrCl2 |
InChI |
InChI=1S/C11H9BrCl2/c12-9-5-8-10(11(8,13)14)7-4-2-1-3-6(7)9/h1-4,8-10H,5H2 |
InChIKey |
YYWVGDANMQDYKJ-UHFFFAOYSA-N |
Molecular Weight |
292.003 g/mol |
SMILES |
C1(C2C3=C(C=CC=C3)C(CC12)Br)(Cl)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.884742 |