| SpectraBase Compound ID | 3fB6dnDlxkY |
|---|---|
| InChI | InChI=1S/C10H16O/c1-8-7-10(2,3)9(8)5-4-6-11/h6H,4-5,7H2,1-3H3 |
| InChIKey | KICUYBPZKBXNRD-UHFFFAOYSA-N |
| Mol Weight | 152.24 g/mol |
| Molecular Formula | C10H16O |
| Exact Mass | 152.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 3bP9hiIh8wc |
|---|---|
| Name | 1(-3-Oxopropyl)-2,4,4-trimethylcyclobutene |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 152.120115134 u |
| Formula | C10H16O |
| InChI | InChI=1S/C10H16O/c1-8-7-10(2,3)9(8)5-4-6-11/h6H,4-5,7H2,1-3H3 |
| InChIKey | KICUYBPZKBXNRD-UHFFFAOYSA-N |
| Molecular Weight | 152.237 g/mol |
| SMILES | C1(=C(C)CC1(C)C)CCC=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.886603 |