| SpectraBase Compound ID | 6YKLBfku4Jb |
|---|---|
| InChI | InChI=1S/C13H16O/c14-13-8-7-11-10-4-2-1-3-9(10)5-6-12(11)13/h5-6,13-14H,1-4,7-8H2 |
| InChIKey | TXESTNTUSCEAPP-UHFFFAOYSA-N |
| Mol Weight | 188.27 g/mol |
| Molecular Formula | C13H16O |
| Exact Mass | 188.120115 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | CTd9FTmAzCo |
|---|---|
| Name | as-Hydrindacene-1-ol |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 188.120115134 u |
| Formula | C13H16O |
| InChI | InChI=1S/C13H16O/c14-13-8-7-11-10-4-2-1-3-9(10)5-6-12(11)13/h5-6,13-14H,1-4,7-8H2 |
| InChIKey | TXESTNTUSCEAPP-UHFFFAOYSA-N |
| Molecular Weight | 188.270 g/mol |
| SMILES | C1=C2C(CCC2O)=C2C(=C1)CCCC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.944904 |