SpectraBase Compound ID | FDSqKWf7gTB |
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InChI | InChI=1S/C17H34O2/c1-4-7-8-9-10-11-12-13-15-16(14-5-2)19-17(18)6-3/h16H,4-15H2,1-3H3 |
InChIKey | HXNUAWKUANNTSO-UHFFFAOYSA-N |
Mol Weight | 270.5 g/mol |
Molecular Formula | C17H34O2 |
Exact Mass | 270.25588 g/mol |
SpectraBase Spectrum ID | KboqWPZRA00 |
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Name | 4-Propionyloxytetradecane |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 270.255880333 u |
Formula | C17H34O2 |
InChI | InChI=1S/C17H34O2/c1-4-7-8-9-10-11-12-13-15-16(14-5-2)19-17(18)6-3/h16H,4-15H2,1-3H3 |
InChIKey | HXNUAWKUANNTSO-UHFFFAOYSA-N |
Molecular Weight | 270.457 g/mol |
SMILES | C(C(CCCCCCCCCC)OC(CC)=O)CC |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.950777 |