SpectraBase Compound ID | GUVGFCiS8WO |
---|---|
InChI | InChI=1S/C13H20O2/c1-11(14)15-13-8-5-3-2-4-6-12(10-13)7-9-13/h7H,2-6,8-10H2,1H3 |
InChIKey | JKGQSOGGOYEQRE-UHFFFAOYSA-N |
Mol Weight | 208.3 g/mol |
Molecular Formula | C13H20O2 |
Exact Mass | 208.14633 g/mol |
SpectraBase Spectrum ID | 3oDn1Jo7iWC |
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Name | Bicyclo[6.2.1]undec-8-en-1-ol, acetate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 208.146329882 u |
Formula | C13H20O2 |
InChI | InChI=1S/C13H20O2/c1-11(14)15-13-8-5-3-2-4-6-12(10-13)7-9-13/h7H,2-6,8-10H2,1H3 |
InChIKey | JKGQSOGGOYEQRE-UHFFFAOYSA-N |
Molecular Weight | 208.301 g/mol |
SMILES | C12(OC(=O)C)CC(CCCCCC2)=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.816908 |