| SpectraBase Compound ID | 8viX3Qf7NK |
|---|---|
| InChI | InChI=1S/C18H17NO3/c1-19-15-10-5-4-9-14(15)16(17(22-3)18(19)20)12-7-6-8-13(11-12)21-2/h4-11H,1-3H3 |
| InChIKey | NTIXIFUUAMGZBV-UHFFFAOYSA-N |
| Mol Weight | 295.34 g/mol |
| Molecular Formula | C18H17NO3 |
| Exact Mass | 295.120843 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | DlFEUDp3FGG |
|---|---|
| Name | Viridicatol, 3me derivative |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 295.120843408 u |
| Formula | C18H17NO3 |
| InChI | InChI=1S/C18H17NO3/c1-19-15-10-5-4-9-14(15)16(17(22-3)18(19)20)12-7-6-8-13(11-12)21-2/h4-11H,1-3H3 |
| InChIKey | NTIXIFUUAMGZBV-UHFFFAOYSA-N |
| SMILES | C1=CC=C2N(C(C(=C(C2=C1)C1=CC(=CC=C1)OC)OC)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.827017 |