| SpectraBase Spectrum ID |
7BM7mmSFfO3 |
| Name |
Isonicotinic acid, compound with 1,2-diphenylethylamine(1:1) |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.152477890 u |
| Formula |
C20H20N2O2 |
| InChI |
InChI=1S/C14H15N.C6H5NO2/c15-14(13-9-5-2-6-10-13)11-12-7-3-1-4-8-12;8-6(9)5-1-3-7-4-2-5/h1-10,14H,11,15H2;1-4H,(H,8,9) |
| InChIKey |
NKDNTYMRJDCMHA-UHFFFAOYSA-N |
| Molecular Weight |
320.392 g/mol |
| SMILES |
NC(CC1=CC=CC=C1)C=1C=CC=CC1.OC(C=1C=CN=CC1)=O |
