| SpectraBase Spectrum ID |
Ip5OnfzI4la |
| Name |
4-(4-Bromophenyl)-3,7,7-trimethyl-2,4,6,8-tetrahydro-1H-pyrazolo[3,4-B]quinolin-5-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
385.078975275 u |
| Formula |
C19H20BrN3O |
| InChI |
InChI=1S/C19H20BrN3O/c1-10-15-16(11-4-6-12(20)7-5-11)17-13(21-18(15)23-22-10)8-19(2,3)9-14(17)24/h4-7,16H,8-9H2,1-3H3,(H2,21,22,23) |
| InChIKey |
IXLLCUURXQBWNS-UHFFFAOYSA-N |
| Molecular Weight |
386.293 g/mol |
| SMILES |
C=12NC=3CC(CC(C3C(C2=C(NN1)C)C=1C=CC(=CC1)Br)=O)(C)C |
![4-(4-bromophenyl)-3,7,7-trimethyl-2,4,6,8-tetrahydro-1H-pyrazolo[3,4-b]quinolin-5-one](/api/spectrum/Ip5OnfzI4la/structure.png?h=300&w=458 "4-(4-bromophenyl)-3,7,7-trimethyl-2,4,6,8-tetrahydro-1H-pyrazolo[3,4-b]quinolin-5-one")
