| SpectraBase Spectrum ID |
9gwhXMsauIF |
| Name |
4-(3-Methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzonitrile |
| Alternate Name(s) |
4-(3-Methyl-5-oxo-4H-pyrazol-1-yl)benzonitrile
4-(3-Methyl-5-oxidanylidene-4H-pyrazol-1-yl)benzenecarbonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H9N3O |
| InChI |
InChI=1S/C11H9N3O/c1-8-6-11(15)14(13-8)10-4-2-9(7-12)3-5-10/h2-5H,6H2,1H3 |
| InChIKey |
LDWDOWUYGPZPLX-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1039/c4cc05237d |
| Molecular Weight |
199.213 g/mol |
| SMILES |
c1(N2C(CC(=N2)C)=O)ccc(cc1)C#N |
| SPLASH |
splash10-0fr2-0900000000-68d631f1e53f5761659f |
| Source of Spectrum |
KD-50-13121/SM-1h |
| Wiley ID |
1754887 |
