| SpectraBase Compound ID | 9CfcfFSeorV |
|---|---|
| InChI | InChI=1S/C18H25NO2/c1-4-9-16-14-19(3)13-12-18(16,21-17(20)5-2)15-10-7-6-8-11-15/h4,6-8,10-11,16H,1,5,9,12-14H2,2-3H3 |
| InChIKey | KGYFOSCXVAXULR-UHFFFAOYSA-N |
| Mol Weight | 287.4 g/mol |
| Molecular Formula | C18H25NO2 |
| Exact Mass | 287.188529 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 9S68otmRrCG |
|---|---|
| Name | Allylprodine in kbr |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 287.188529047 u |
| Formula | C18H25NO2 |
| InChI | InChI=1S/C18H25NO2/c1-4-9-16-14-19(3)13-12-18(16,21-17(20)5-2)15-10-7-6-8-11-15/h4,6-8,10-11,16H,1,5,9,12-14H2,2-3H3 |
| InChIKey | KGYFOSCXVAXULR-UHFFFAOYSA-N |
| Molecular Weight | 287.403 g/mol |
| SMILES | CCC(OC1(CCN(CC1CC=C)C)C=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Raman) | 0.99272 |