| SpectraBase Compound ID | FiA1TrNPcj5 |
|---|---|
| InChI | InChI=1S/C26H41NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26(28)27-23-24-19-18-20-25(22-24)29-2/h7-8,10-11,18-20,22H,3-6,9,12-17,21,23H2,1-2H3,(H,27,28)/b8-7-,11-10- |
| InChIKey | BMQBTHWVNBJSPS-NQLNTKRDSA-N |
| Mol Weight | 399.6 g/mol |
| Molecular Formula | C26H41NO2 |
| Exact Mass | 399.31373 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | JxJEPWUTrpS |
|---|---|
| Name | N-(3-Methoxy)benzyllinoleamide |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 399.313729562 u |
| Formula | C26H41NO2 |
| InChI | InChI=1S/C26H41NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26(28)27-23-24-19-18-20-25(22-24)29-2/h7-8,10-11,18-20,22H,3-6,9,12-17,21,23H2,1-2H3,(H,27,28)/b8-7-,11-10- |
| InChIKey | BMQBTHWVNBJSPS-NQLNTKRDSA-N |
| Molecular Weight | 399.619 g/mol |
| SMILES | C(CCCCCCC\C=C/C\C=C/CCCCC)(=O)NCC1=CC(=CC=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.884057 |