| SpectraBase Compound ID | 2KtF3D04Ykv |
|---|---|
| InChI | InChI=1S/C18H17NO2/c1-18(2,3)17(20)21-15-10-6-8-13-11-12-7-4-5-9-14(12)19-16(13)15/h4-11H,1-3H3 |
| InChIKey | AJMSXDHSJNEKHZ-UHFFFAOYSA-N |
| Mol Weight | 279.34 g/mol |
| Molecular Formula | C18H17NO2 |
| Exact Mass | 279.125929 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 769Xu6sjPzi |
|---|---|
| Name | 4-Acridinol, trimethylacetate |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 279.125928789 u |
| Formula | C18H17NO2 |
| InChI | InChI=1S/C18H17NO2/c1-18(2,3)17(20)21-15-10-6-8-13-11-12-7-4-5-9-14(12)19-16(13)15/h4-11H,1-3H3 |
| InChIKey | AJMSXDHSJNEKHZ-UHFFFAOYSA-N |
| Molecular Weight | 279.339 g/mol |
| SMILES | C12=NC3=C(C=C2C=CC=C1OC(C(C)(C)C)=O)C=CC=C3 |