| SpectraBase Compound ID | 9JJJjZkeyNM |
|---|---|
| InChI | InChI=1S/C16H26FNO3/c1-5-18-12(2)9-13-10-14(19-3)16(15(11-13)20-4)21-8-6-7-17/h10-12,18H,5-9H2,1-4H3 |
| InChIKey | XJMAHRYNRIEGLV-UHFFFAOYSA-N |
| Mol Weight | 299.39 g/mol |
| Molecular Formula | C16H26FNO3 |
| Exact Mass | 299.189672 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | 2m5jF3iIP4Y |
|---|---|
| Name | 3C-fp et |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 299.189671861 u |
| Formula | C16H26FNO3 |
| InChI | InChI=1S/C16H26FNO3/c1-5-18-12(2)9-13-10-14(19-3)16(15(11-13)20-4)21-8-6-7-17/h10-12,18H,5-9H2,1-4H3 |
| InChIKey | XJMAHRYNRIEGLV-UHFFFAOYSA-N |
| Molecular Weight | 299.386 g/mol |
| SMILES | C1(=C(C=C(C=C1OC)CC(NCC)C)OC)OCCCF |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.91358 |