| SpectraBase Spectrum ID |
2pLVJzCzk0M |
| Name |
4-[(2-Nitrophenyl)methylene]-2,4-dihydro-5-(hydroxymethyl)-3H-pyrazol-3-one |
| Alternate Name(s) |
(4E)-5-(hydroxymethyl)-4-(2-nitrobenzylidene)-2,4-dihydro-3H-pyrazol-3-one |
| CAS Registry Number |
87192-04-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H9N3O4 |
| InChI |
InChI=1S/C11H9N3O4/c15-6-9-8(11(16)13-12-9)5-7-3-1-2-4-10(7)14(17)18/h1-5,15H,6H2,(H,13,16)/b8-5+ |
| InChIKey |
OSDQIXWREAPZDZ-VMPITWQZSA-N |
| Molecular Weight |
247.210 g/mol |
| SMILES |
N1N=C(CO)\C(=C/c2c(N(=O)=O)cccc2)C1=O |
| SPLASH |
splash10-000i-0900000000-41d6a307c7dfa003cf3e |
| Source of Spectrum |
J-48-4369-0 |
| Wiley ID |
1249787 |
![4-[(2-Nitrophenyl)methylene]-2,4-dihydro-5-(hydroxymethyl)-3H-pyrazol-3-one](/api/spectrum/2pLVJzCzk0M/structure.png?h=300&w=458 "4-[(2-Nitrophenyl)methylene]-2,4-dihydro-5-(hydroxymethyl)-3H-pyrazol-3-one")
