SpectraBase Compound ID | GxMmlolCchn |
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InChI | InChI=1S/C7H12Cl2O/c8-4-6-2-1-3-7(5-9)10-6/h6-7H,1-5H2 |
InChIKey | ZSKCLFLVFVIDMW-UHFFFAOYSA-N |
Mol Weight | 183.08 g/mol |
Molecular Formula | C7H12Cl2O |
Exact Mass | 182.02652 g/mol |
SpectraBase Spectrum ID | H4Q11PrMr0j |
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Name | 2,6-bis(Chloromethyl)tetrahydropyran |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 182.026520405 u |
Formula | C7H12Cl2O |
InChI | InChI=1S/C7H12Cl2O/c8-4-6-2-1-3-7(5-9)10-6/h6-7H,1-5H2 |
InChIKey | ZSKCLFLVFVIDMW-UHFFFAOYSA-N |
Molecular Weight | 183.078 g/mol |
SMILES | C(Cl)C1OC(CCC1)CCl |
Spectrum/Structure Validation Score (Raman) | 0.946525 |