| SpectraBase Spectrum ID |
9GXPWuxAapa |
| Name |
1-(7-chloroquinolin-4-yl)-5-(dichloromethyl)-N,N-dimethyl-4-nitro-1H-pyrazol-3-amine |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
399.005657744 u |
| Formula |
C15H12Cl3N5O2 |
| InChI |
InChI=1S/C15H12Cl3N5O2/c1-21(2)15-13(23(24)25)12(14(17)18)22(20-15)11-5-6-19-10-7-8(16)3-4-9(10)11/h3-7,14H,1-2H3 |
| InChIKey |
JLIZAQCEBKENOT-UHFFFAOYSA-N |
| Instrument Name |
Hewlett-Packard 5989B |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.18.54 |
| Molecular Weight |
400.653 g/mol |
| Quality |
209 |
| Reported Formula |
C15H12Cl3N5O2 |
| SMILES |
C12=C(C=CN=C2C=C(C=C1)Cl)N1N=C(C(=C1C(Cl)Cl)[N+]([O-])=O)N(C)C |
| SPLASH |
splash10-03di-0809300000-e03bfcfcff839f8ad350 |
| Source of Spectrum |
BJO-18-SM10-5b (DOI: 10.3762/bjoc.18.54) |
| Wiley ID |
1901299 |
