SpectraBase Spectrum ID |
247IEnnhR2 |
Name |
7-Chloro-4-(5'-(dichloromethyl)-4'-nitro-1'H-[1,3'-bipyrazol]-1'-yl)quinoline |
Appearance |
Light yellow solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
421.985256652 u |
Formula |
C16H9Cl3N6O2 |
InChI |
InChI=1S/C16H9Cl3N6O2/c17-9-2-3-10-11(8-9)20-6-4-12(10)24-13(15(18)19)14(25(26)27)16(22-24)23-7-1-5-21-23/h1-8,15H |
InChIKey |
QTOIDUQVLQVVDZ-UHFFFAOYSA-N |
Instrument Name |
Hewlett-Packard 5989B |
Ionization Type |
EI |
Literature Reference DOI |
10.3762/bjoc.18.54 |
Molecular Weight |
423.647 g/mol |
Quality |
258 |
Reported Formula |
C16H9Cl3N6O2 |
SMILES |
C12=C(C=CN=C2C=C(C=C1)Cl)N1N=C(C(=C1C(Cl)Cl)[N+]([O-])=O)N1C=CC=N1 |
SPLASH |
splash10-00di-3203900000-60421f487afb0da23374 |
Source of Spectrum |
BJO-18-SM4-3a (DOI: 10.3762/bjoc.18.54) |
Wiley ID |
1901293 |