| SpectraBase Compound ID | KYWQABVFMop |
|---|---|
| InChI | InChI=1S/C10H20O2/c1-8(6-7-11)4-5-9-10(2,3)12-9/h8-9,11H,4-7H2,1-3H3 |
| InChIKey | KCNJNSNPPWXJGM-UHFFFAOYSA-N |
| Mol Weight | 172.27 g/mol |
| Molecular Formula | C10H20O2 |
| Exact Mass | 172.14633 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CQQQcqmmqRG |
|---|---|
| Name | 6,7-Epoxy-citronellol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 172.146329882 u |
| Formula | C10H20O2 |
| InChI | InChI=1S/C10H20O2/c1-8(6-7-11)4-5-9-10(2,3)12-9/h8-9,11H,4-7H2,1-3H3 |
| InChIKey | KCNJNSNPPWXJGM-UHFFFAOYSA-N |
| Molecular Weight | 172.268 g/mol |
| SMILES | C(O)CC(CCC1C(O1)(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.920084 |