SpectraBase Compound ID | 9T1rMZn4AxU |
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InChI | InChI=1S/C11H18O2/c1-7(12)13-10-8-4-5-9(6-8)11(10,2)3/h8-10H,4-6H2,1-3H3 |
InChIKey | AIFCYJPQMNVEEG-UHFFFAOYSA-N |
Mol Weight | 182.26 g/mol |
Molecular Formula | C11H18O2 |
Exact Mass | 182.13068 g/mol |
SpectraBase Spectrum ID | AtbqKpthlAI |
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Name | 2-Norbornanol, 3,3-dimethyl-, acetate |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 182.130679818 u |
Formula | C11H18O2 |
InChI | InChI=1S/C11H18O2/c1-7(12)13-10-8-4-5-9(6-8)11(10,2)3/h8-10H,4-6H2,1-3H3 |
InChIKey | AIFCYJPQMNVEEG-UHFFFAOYSA-N |
Molecular Weight | 182.263 g/mol |
SMILES | C12C(C(C)(C)C(C2)CC1)OC(C)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.973454 |