SpectraBase Compound ID | 6RdGZvexEWb |
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InChI | InChI=1S/C16H15N3O3/c1-20-13-8-5-11(9-14(13)21-2)16-19-18-15(22-16)10-3-6-12(17)7-4-10/h3-9H,17H2,1-2H3 |
InChIKey | HTFMZBUQMFAFBD-UHFFFAOYSA-N |
Mol Weight | 297.31 g/mol |
Molecular Formula | C16H15N3O3 |
Exact Mass | 297.111341 g/mol |
SpectraBase Spectrum ID | 6bG0yOvf0l3 |
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Name | 4-[5-(3,4-Dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]aniline |
Comments | Computed using HOSE algorithm |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 297.111341352 u |
Formula | C16H15N3O3 |
InChI | InChI=1S/C16H15N3O3/c1-20-13-8-5-11(9-14(13)21-2)16-19-18-15(22-16)10-3-6-12(17)7-4-10/h3-9H,17H2,1-2H3 |
InChIKey | HTFMZBUQMFAFBD-UHFFFAOYSA-N |
SMILES | COC1=C(OC)C=CC(C=2OC(=NN2)C2=CC=C(C=C2)N)=C1 |