SpectraBase Compound ID | 8FYAajmSd1 |
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InChI | InChI=1S/C8H14Cl2O/c1-8(2)4-3-6(11-8)5-7(9)10/h6-7H,3-5H2,1-2H3 |
InChIKey | MCJHXGXWGRMDEL-UHFFFAOYSA-N |
Mol Weight | 197.1 g/mol |
Molecular Formula | C8H14Cl2O |
Exact Mass | 196.04217 g/mol |
SpectraBase Spectrum ID | 1udi8g0IymS |
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Name | Furan, 5-(2,2-dichloroethyl)tetrahydro-2,2-dimethyl- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 196.042170470 u |
Formula | C8H14Cl2O |
InChI | InChI=1S/C8H14Cl2O/c1-8(2)4-3-6(11-8)5-7(9)10/h6-7H,3-5H2,1-2H3 |
InChIKey | MCJHXGXWGRMDEL-UHFFFAOYSA-N |
Molecular Weight | 197.105 g/mol |
SMILES | C1(OC(CC1)CC(Cl)Cl)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.939664 |