SpectraBase Compound ID | JlKOng8pEh3 |
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InChI | InChI=1S/C12H23ClO/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h8,10,14H,1-7,9,11-12H2/b10-8+ |
InChIKey | GUBHEEWHWNHEAB-CSKARUKUSA-N |
Mol Weight | 218.77 g/mol |
Molecular Formula | C12H23ClO |
Exact Mass | 218.143743 g/mol |
SpectraBase Spectrum ID | EGLjHSFC8S0 |
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Name | 2-Dodecen-1-ol, 12-chloro- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 218.143743060 u |
Formula | C12H23ClO |
InChI | InChI=1S/C12H23ClO/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h8,10,14H,1-7,9,11-12H2/b10-8+ |
InChIKey | GUBHEEWHWNHEAB-CSKARUKUSA-N |
Molecular Weight | 218.768 g/mol |
SMILES | C(CCCCCCCl)CC\C=C\CO |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.898629 |