SpectraBase Compound ID | 4YlJmk7vqmL |
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InChI | InChI=1S/C11H20O/c1-3-4-5-6-10-9(2)7-8-11(10)12/h4-5,9-12H,3,6-8H2,1-2H3/b5-4- |
InChIKey | LODKRBXFYBNIEX-PLNGDYQASA-N |
Mol Weight | 168.28 g/mol |
Molecular Formula | C11H20O |
Exact Mass | 168.151415 g/mol |
SpectraBase Spectrum ID | 77wfkGrgr69 |
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Name | Cyclopentanol, 3-methyl-2-(2-pentenyl)- |
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/c1-3-4-5-6-10-9(2)7-8-11(10)12/h4-5,9-12H,3,6-8H2,1-2H3/b5-4- |
InChIKey | LODKRBXFYBNIEX-PLNGDYQASA-N |
Molecular Weight | 168.280 g/mol |
SMILES | C1(O)CCC(C1C\C=C/CC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.874556 |