| SpectraBase Compound ID | 29jDs4JcWd8 |
|---|---|
| InChI | InChI=1S/C13H28O3/c1-7-10(4)14-13(15-11(5)8-2)16-12(6)9-3/h10-13H,7-9H2,1-6H3 |
| InChIKey | IFHAZTNQCKGTRS-UHFFFAOYSA-N |
| Mol Weight | 232.36 g/mol |
| Molecular Formula | C13H28O3 |
| Exact Mass | 232.203845 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | G7WaBYv30Nw |
|---|---|
| Name | Orthoformic acid, tri-sec-butyl ester |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 232.203844759 u |
| Formula | C13H28O3 |
| InChI | InChI=1S/C13H28O3/c1-7-10(4)14-13(15-11(5)8-2)16-12(6)9-3/h10-13H,7-9H2,1-6H3 |
| InChIKey | IFHAZTNQCKGTRS-UHFFFAOYSA-N |
| Molecular Weight | 232.364 g/mol |
| SMILES | C(OC(CC)C)(OC(CC)C)OC(CC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.975028 |