SpectraBase Compound ID | Dz7T0cXZS5c |
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InChI | InChI=1S/C7H15ClO/c1-3-4-5-9-7(2)6-8/h7H,3-6H2,1-2H3 |
InChIKey | JWUXTYRTINBJKV-UHFFFAOYSA-N |
Mol Weight | 150.65 g/mol |
Molecular Formula | C7H15ClO |
Exact Mass | 150.081143 g/mol |
SpectraBase Spectrum ID | CLk9OPzRm9n |
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Name | Ether N-butyl,2-chloro-1-methyl ethyl-, |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 150.081142802 u |
Formula | C7H15ClO |
InChI | InChI=1S/C7H15ClO/c1-3-4-5-9-7(2)6-8/h7H,3-6H2,1-2H3 |
InChIKey | JWUXTYRTINBJKV-UHFFFAOYSA-N |
Molecular Weight | 150.649 g/mol |
SMILES | C(Cl)C(OCCCC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.915567 |