| SpectraBase Spectrum ID |
2NObSSrnoqd |
| Name |
4-(4-Chlorophenyl)-1-(1-(7-chloroquinolin-4-yl)-5-(dichloromethyl)-4-nitro-1Hpyrazol-3-yl)piperidin-4-ol |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
565.024200289 u |
| Formula |
C24H19Cl4N5O3 |
| InChI |
InChI=1S/C24H19Cl4N5O3/c25-15-3-1-14(2-4-15)24(34)8-11-31(12-9-24)23-21(33(35)36)20(22(27)28)32(30-23)19-7-10-29-18-13-16(26)5-6-17(18)19/h1-7,10,13,22,34H,8-9,11-12H2 |
| InChIKey |
PUDUFBYOZQSDNV-UHFFFAOYSA-N |
| Instrument Name |
Hewlett-Packard 5989B |
| Ionization Type |
EI |
| Literature Reference DOI |
10.3762/bjoc.18.54 |
| Molecular Weight |
567.260 g/mol |
| Quality |
102 |
| Reported Formula |
C24H19Cl4N5O3 |
| SMILES |
OC1(CCN(C2=NN(C3=C4C(=NC=C3)C=C(C=C4)Cl)C(=C2[N+]([O-])=O)C(Cl)Cl)CC1)C1=CC=C(C=C1)Cl |
| SPLASH |
splash10-000i-0900060000-2e56a3fb5f06d1363007 |
| Source of Spectrum |
BJO-18-SM12-5f (DOI: 10.3762/bjoc.18.54) |
| Wiley ID |
1901303 |
