SpectraBase Compound ID | EqZcJAOEy7v |
---|---|
InChI | InChI=1S/C5H10Br2/c1-4(6)3-5(2)7/h4-5H,3H2,1-2H3 |
InChIKey | KUZOHDYKJXNCSI-UHFFFAOYSA-N |
Mol Weight | 229.94 g/mol |
Molecular Formula | C5H10Br2 |
Exact Mass | 227.914926 g/mol |
SpectraBase Spectrum ID | CgBDfOPF1rR |
---|---|
Name | 2,4-Dibromopentane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 227.914926322 u |
Formula | C5H10Br2 |
InChI | InChI=1S/C5H10Br2/c1-4(6)3-5(2)7/h4-5H,3H2,1-2H3 |
InChIKey | KUZOHDYKJXNCSI-UHFFFAOYSA-N |
Molecular Weight | 229.943 g/mol |
SMILES | CC(CC(C)Br)Br |
Spectrum/Structure Validation Score (Raman) | 0.800209 |