| SpectraBase Compound ID | DVp2kojDnHc |
|---|---|
| InChI | InChI=1S/C7H13IO3/c1-10-7-3-5(9)2-6(4-8)11-7/h5-7,9H,2-4H2,1H3 |
| InChIKey | IXUJGSBZHBKHDO-UHFFFAOYSA-N |
| Mol Weight | 272.08 g/mol |
| Molecular Formula | C7H13IO3 |
| Exact Mass | 271.990939 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | IMzR9KG1DFa |
|---|---|
| Name | 2H-Pyran-4-ol, tetrahydro-2-(iodomethyl)-6-methoxy- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 271.990939276 u |
| Formula | C7H13IO3 |
| InChI | InChI=1S/C7H13IO3/c1-10-7-3-5(9)2-6(4-8)11-7/h5-7,9H,2-4H2,1H3 |
| InChIKey | IXUJGSBZHBKHDO-UHFFFAOYSA-N |
| Molecular Weight | 272.082 g/mol |
| SMILES | C1(OC(CC(C1)O)CI)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.862953 |