| SpectraBase Compound ID | 7uTxKlseTv7 |
|---|---|
| InChI | InChI=1S/C10H16O/c11-10-7-2-1-4-8-5-3-6-9(8)10/h8-9H,1-7H2 |
| InChIKey | LRWIWGKEXZQIPK-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 | J0gcv6Mq7Ho |
|---|---|
| Name | 2,3,3A,5,6,7,8,8A-Octahydro-1H-azulen-4-one |
| 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/c11-10-7-2-1-4-8-5-3-6-9(8)10/h8-9H,1-7H2 |
| InChIKey | LRWIWGKEXZQIPK-UHFFFAOYSA-N |
| Molecular Weight | 152.237 g/mol |
| SMILES | C1(C2C(CCC2)CCCC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.955138 |