SpectraBase Spectrum ID |
FvMO53IrWT0 |
Name |
Ethyl 4-chlorodimethylaminomethylenamino-3-cyanopyrazolo[5,1-c][1,2,4]triazine-8-carboxylate |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C12H12ClN7O2 |
InChI |
InChI=1S/C12H12ClN7O2/c1-4-22-11(21)7-6-15-20-9(7)18-17-8(5-14)10(20)16-12(13)19(2)3/h6H,4H2,1-3H3/b16-12+ |
InChIKey |
VDCBOMJLEQUIPS-FOWTUZBSSA-N |
Molecular Weight |
321.728 g/mol |
SMILES |
c12[n](ncc2C(=O)OCC)C(=C(N=N1)C#N)\N=C\(N(C)C)Cl |
SPLASH |
splash10-0002-0091000000-500f6a06cfaecad763fb |
Source of Spectrum |
F-52-3044-7 |
Synonyms |
ethyl 4-{[(Z)-chloro(dimethylamino)methylidene]amino}-3-cyanopyrazolo[5,1-c][1,2,4]triazine-8-carboxylate |
Wiley ID |
795381 |