| SpectraBase Spectrum ID |
3kSjKG1Z2er |
| Name |
6-Demethyl-3-(4'-chlorophenyl)fervenulin-4-oxide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H8ClN5O3 |
| InChI |
InChI=1S/C12H8ClN5O3/c1-17-10-8(11(19)14-12(17)20)18(21)9(15-16-10)6-2-4-7(13)5-3-6/h2-5H,1H3,(H,14,19,20) |
| InChIKey |
GBROYRSVHBZDFF-UHFFFAOYSA-N |
| Molecular Weight |
305.681 g/mol |
| SMILES |
N1C(c2c(N(C1=O)C)nnc([n+]2[O-])-c1ccc(cc1)Cl)=O |
| SPLASH |
splash10-0570-0191000000-4cac9d053bcd25c1b376 |
| Source of Spectrum |
AH-130-825-23 |
| Synonyms |
3-(4-Chlorophenyl)-8-methyl-4-oxidopyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione
3-(4-Chlorophenyl)-8-methyl-4-oxido-pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione
3-(4-Chlorophenyl)-8-methyl-4-oxidanidyl-pyrimido[5,4-e][1,2,4]triazin-4-ium-5,7-dione |
| Wiley ID |
770753 |
