| SpectraBase Spectrum ID |
Icd1DOeeRtl |
| Name |
3-[3'-(4'',5''-Dihydro-1''-formyl-5''-phenyl-1H-pyrazol-3''-yl)phenyl]-5-methyl-1,3,4-oxadiazol-2(3H)-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
348.122240388 u |
| Formula |
C19H16N4O3 |
| InChI |
InChI=1S/C19H16N4O3/c1-13-20-23(19(25)26-13)16-9-5-8-15(10-16)17-11-18(22(12-24)21-17)14-6-3-2-4-7-14/h2-10,12,18H,11H2,1H3 |
| InChIKey |
PIEGADRAJPDVQW-UHFFFAOYSA-N |
| Molecular Weight |
348.362 g/mol |
| SMILES |
C1(N(N=C(O1)C)C=1C=C(C2=NN(C=O)C(C2)C=2C=CC=CC2)C=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.802715 |
![3-[3'-(4'',5''-Dihydro-1"-formyl-5"-phenyl-1H-pyrazol-3"-yl)phenyl]-5-methyl-1,3,4-oxadiazol-2(3H)-one](/api/spectrum/Icd1DOeeRtl/structure.png?h=300&w=458 "3-[3'-(4'',5''-Dihydro-1\"-formyl-5\"-phenyl-1H-pyrazol-3\"-yl)phenyl]-5-methyl-1,3,4-oxadiazol-2(3H)-one")
