SpectraBase Compound ID | DdENcbPrycV |
---|---|
InChI | InChI=1S/C5H10Cl2/c1-4(6)3-5(2)7/h4-5H,3H2,1-2H3 |
InChIKey | DYGOBGYJRRKFEN-UHFFFAOYSA-N |
Mol Weight | 141.04 g/mol |
Molecular Formula | C5H10Cl2 |
Exact Mass | 140.015956 g/mol |
SpectraBase Spectrum ID | IvavujHYASO |
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Name | Meso-2,4-dichloropentane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 140.015955722 u |
Formula | C5H10Cl2 |
InChI | InChI=1S/C5H10Cl2/c1-4(6)3-5(2)7/h4-5H,3H2,1-2H3 |
InChIKey | DYGOBGYJRRKFEN-UHFFFAOYSA-N |
SMILES | C(Cl)(C)CC(Cl)C |
Spectrum/Structure Validation Score (Raman) | 0.844228 |