| SpectraBase Compound ID | 1iowPgKM4Mu |
|---|---|
| InChI | InChI=1S/C10H16O2/c1-7-5-10(2,3)6-8(11)9(7)12-4/h5-6H2,1-4H3 |
| InChIKey | BRXDVFXLLXAJKA-UHFFFAOYSA-N |
| Mol Weight | 168.24 g/mol |
| Molecular Formula | C10H16O2 |
| Exact Mass | 168.11503 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | LAZ811pfZxR |
|---|---|
| Name | 2-Methoxy-3,5,5-trimethyl-2-cyclohexenone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 168.115029753 u |
| Formula | C10H16O2 |
| InChI | InChI=1S/C10H16O2/c1-7-5-10(2,3)6-8(11)9(7)12-4/h5-6H2,1-4H3 |
| InChIKey | BRXDVFXLLXAJKA-UHFFFAOYSA-N |
| Molecular Weight | 168.236 g/mol |
| SMILES | C1(=C(CC(CC1=O)(C)C)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.967946 |