| SpectraBase Compound ID | Kpv1iidMrek |
|---|---|
| InChI | InChI=1S/C7H13NO/c1-5(2)7-4-9-6(3)8-7/h5,7H,4H2,1-3H3 |
| InChIKey | FOPMZVNMDQVZKG-UHFFFAOYSA-N |
| Mol Weight | 127.19 g/mol |
| Molecular Formula | C7H13NO |
| Exact Mass | 127.099714 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | AKZ0tHfDQqD |
|---|---|
| Name | 2-Methyl-4-propan-2-yl-4,5-dihydro-1,3-oxazole |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 127.099714042 u |
| Formula | C7H13NO |
| InChI | InChI=1S/C7H13NO/c1-5(2)7-4-9-6(3)8-7/h5,7H,4H2,1-3H3 |
| InChIKey | FOPMZVNMDQVZKG-UHFFFAOYSA-N |
| Molecular Weight | 127.187 g/mol |
| SMILES | C=1(OCC(N1)C(C)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.918775 |