| SpectraBase Spectrum ID |
KoUJNZ2KHtT |
| Name |
1,2,4,5-Tetrazine-3-carboxylic acid, 1,2,5,6-tetrahydro-5-(4-chlorophenyl)-2-methyl-6-(4-nitrophenyl)-, ethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H18ClN5O4 |
| InChI |
InChI=1S/C18H18ClN5O4/c1-3-28-18(25)17-21-23(14-10-6-13(19)7-11-14)16(20-22(17)2)12-4-8-15(9-5-12)24(26)27/h4-11,16,20H,3H2,1-2H3 |
| InChIKey |
XBRVHLCGBXQICP-UHFFFAOYSA-N |
| Molecular Weight |
403.826 g/mol |
| SMILES |
N1N(C(=NN(C1c1ccc(N(=O)=O)cc1)c1ccc(cc1)Cl)C(=O)OCC)C |
| SPLASH |
splash10-03fu-5920000000-063fdc33594b54b63395 |
| Source of Spectrum |
AD-0-2532-0 |
| Synonyms |
5-(4-Chlorophenyl)-2-methyl-6-(4-nitrophenyl)-1,6-dihydro-1,2,4,5-tetrazine-3-carboxylic acid ethyl ester
Ethyl 5-(4-chlorophenyl)-2-methyl-6-(4-nitrophenyl)-1,2,5,6-tetrahydro-1,2,4,5-tetraazine-3-carboxylate
Ethyl 5-(4-chlorophenyl)-2-methyl-6-(4-nitrophenyl)-1,6-dihydro-1,2,4,5-tetrazine-3-carboxylate |
| Wiley ID |
1419503 |
