| SpectraBase Compound ID | 9t9p9ctA3dH |
|---|---|
| InChI | InChI=1S/C19H38O2/c1-4-18(2)16-14-12-10-8-6-5-7-9-11-13-15-17-21-19(3)20/h18H,4-17H2,1-3H3/t18-/m1/s1 |
| InChIKey | BWYNHTOHVSBZTG-GOSISDBHSA-N |
| Mol Weight | 298.5 g/mol |
| Molecular Formula | C19H38O2 |
| Exact Mass | 298.28718 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 237N6qtgcQ4 |
|---|---|
| Name | R-14-Methylhexadecyl acetate |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 298.287180462 u |
| Formula | C19H38O2 |
| InChI | InChI=1S/C19H38O2/c1-4-18(2)16-14-12-10-8-6-5-7-9-11-13-15-17-21-19(3)20/h18H,4-17H2,1-3H3/t18-/m1/s1 |
| InChIKey | BWYNHTOHVSBZTG-GOSISDBHSA-N |
| SMILES | C(=O)(OCCCCCCCCCCCCC[C@@](CC)(C)[H])C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.861541 |