| SpectraBase Spectrum ID |
2DeAPxSP5s |
| Name |
(Z)-7-Chloro-2,3-Dihydro-3-(4H-1,2,4-triazol-4-yl)-4H-1-benzopyran-4-one O-(2,6-dichlorophenylmethyl)oxime nitrate |
| Alternate Name(s) |
Nitric acid compound with (4Z)-7-chloro-3-(4H-1,2,4-triazol-4-yl)-2,3-dihydro-4H-chromen-4-one O-(2,6-dichlorobenzyl)oxime (1:1) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H14Cl3N5O5 |
| InChI |
InChI=1S/C18H13Cl3N4O2.HNO3/c19-11-4-5-12-17(6-11)26-8-16(25-9-22-23-10-25)18(12)24-27-7-13-14(20)2-1-3-15(13)21;2-1(3)4/h1-6,9-10,16H,7-8H2;(H,2,3,4)/b24-18-; |
| InChIKey |
CUDWZRIVZOJCCH-XWASNXTISA-N |
| Molecular Weight |
486.699 g/mol |
| SMILES |
ON(=O)=O.C1C(\C(c2c(O1)cc(cc2)Cl)=N/OCc1c(cccc1Cl)Cl)[n]1cnnc1 |
| SPLASH |
splash10-01r2-2930000000-da60112143ceb01f8c91 |
| Source of Spectrum |
H1-55-2072-17 |
| Wiley ID |
1564689 |
