| SpectraBase Compound ID | 3Jd59JWXmYi |
|---|---|
| InChI | InChI=1S/C12H20O2/c1-7-10-5-9(12(10,3)4)6-11(7)14-8(2)13/h7,9-11H,5-6H2,1-4H3 |
| InChIKey | KKZUXVTWZQWUSI-UHFFFAOYSA-N |
| Mol Weight | 196.29 g/mol |
| Molecular Formula | C12H20O2 |
| Exact Mass | 196.14633 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JWOI8rhEFsz |
|---|---|
| Name | (-)-isopinocampheol, acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 196.146329882 u |
| Formula | C12H20O2 |
| InChI | InChI=1S/C12H20O2/c1-7-10-5-9(12(10,3)4)6-11(7)14-8(2)13/h7,9-11H,5-6H2,1-4H3 |
| InChIKey | KKZUXVTWZQWUSI-UHFFFAOYSA-N |
| Molecular Weight | 196.290 g/mol |
| SMILES | CC1(C)C2CC1CC(C2C)OC(C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.969347 |