SpectraBase Compound ID | 1B0C3kEkQQk |
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InChI | InChI=1S/C11H20O/c1-6-10(7-8(2)3)11(12)9(4)5/h6-7,9-12H,1H2,2-5H3 |
InChIKey | DNCCXLADPJKABH-UHFFFAOYSA-N |
Mol Weight | 168.28 g/mol |
Molecular Formula | C11H20O |
Exact Mass | 168.151415 g/mol |
SpectraBase Spectrum ID | Dya8XrJvnr0 |
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Name | 2,6-Dimethyl-4-vinylhept-5-en-3-ol |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 168.151415263 u |
Formula | C11H20O |
InChI | InChI=1S/C11H20O/c1-6-10(7-8(2)3)11(12)9(4)5/h6-7,9-12H,1H2,2-5H3 |
InChIKey | DNCCXLADPJKABH-UHFFFAOYSA-N |
Molecular Weight | 168.280 g/mol |
SMILES | CC(C(C(C=C(C)C)C=C)O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.871332 |