| SpectraBase Compound ID | CDYjSLg7E2t |
|---|---|
| InChI | InChI=1S/C19H27NO/c1-2-3-4-5-9-14-18(20-15-10-11-16-20)19(21)17-12-7-6-8-13-17/h6-8,12-14H,2-5,9-11,15-16H2,1H3/b18-14- |
| InChIKey | RXECTWGKMGXNOC-JXAWBTAJSA-N |
| Mol Weight | 285.43 g/mol |
| Molecular Formula | C19H27NO |
| Exact Mass | 285.209264 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DwUXbdUFfYZ |
|---|---|
| Name | pv-10-A (-2H) |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 285.209264492 u |
| Formula | C19H27NO |
| InChI | InChI=1S/C19H27NO/c1-2-3-4-5-9-14-18(20-15-10-11-16-20)19(21)17-12-7-6-8-13-17/h6-8,12-14H,2-5,9-11,15-16H2,1H3/b18-14- |
| InChIKey | RXECTWGKMGXNOC-JXAWBTAJSA-N |
| SMILES | C(\C(N1CCCC1)=C\CCCCCC)(C1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.937322 |