| SpectraBase Spectrum ID |
3SWzX4fq7n6 |
| Name |
trans-4-(4-Bromophenyl)-3-methyl-6-oxo-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile |
| Alternate Name(s) |
(4R,5R)-4-(4-bromophenyl)-3-methyl-6-oxo-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H11BrN4O |
| InChI |
InChI=1S/C14H11BrN4O/c1-7-11-12(8-2-4-9(15)5-3-8)10(6-16)14(20)17-13(11)19-18-7/h2-5,10,12H,1H3,(H2,17,18,19,20)/t10-,12-/m0/s1 |
| InChIKey |
JNFVLKCZASNTDN-JQWIXIFHSA-N |
| Literature Reference DOI |
10.1002/cjoc.201180405 |
| Molecular Weight |
331.173 g/mol |
| SMILES |
N1c2n[nH]c(c2[C@]([C@@](C1=O)(C#N)[H])(c1ccc(cc1)Br)[H])C |
| SPLASH |
splash10-01q9-4397000000-b9422bcb125c80431d35 |
| Source of Spectrum |
CJC-29-2376-4e |
| Wiley ID |
1772485 |
![trans-4-(4-Bromophenyl)-3-methyl-6-oxo-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile](/api/spectrum/3SWzX4fq7n6/structure.png?h=300&w=458 "trans-4-(4-Bromophenyl)-3-methyl-6-oxo-4,5,6,7-tetrahydro-2H-pyrazolo[3,4-b]pyridine-5-carbonitrile")
