IMPURITY-5
Compound with spectra: 3 NMR
| SpectraBase Compound ID | KGFhEpI2akC |
|---|---|
| InChI | InChI=1S/C28H32F7N3O3/c1-16-11-21(29)7-8-22(16)23-15-37(25(40)41-26(3,4)5)9-10-38(23)24(39)36(6)17(2)18-12-19(27(30,31)32)14-20(13-18)28(33,34)35/h7-8,11-14,17,23H,9-10,15H2,1-6H3/t17-,23-/m1/s1 |
| InChIKey | NQMHNJGOPRNQMA-UZUQRXQVSA-N |
| Mol Weight | 591.6 g/mol |
| Molecular Formula | C28H32F7N3O3 |
| Exact Mass | 591.233189 g/mol |
| Enantiomer InChIKey | NQMHNJGOPRNQMA-SBUREZEXSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
IMPURITY-4
IMPURITY-6
2-(1-(mesitylmethyl)-2,4-dioxo-1,4-dihydrothieno[3,2-d]pyrimidin-3(2H)-yl)-N-(2-phenylethyl)acetamide
8-DEUTERIOMIANSERIN
5-(4-bromophenyl)-N-[2-chloro-5-(trifluoromethyl)phenyl]-7-(trifluoromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine-2-carboxamide
2-TRIDEUTERIOMETHYL-2-DESMETHYLMIANSERIN
(R)-5-(3-Amino-phenyl)-3-benzyl-1-(3-fluoro-phenyl)-imidazolidine-2,4-dione
(6S,7 aS)-6-azido-1,1-bis[3,5-bis(trifluoromethyl)phenyl]-tetrahydropyrrolo[1,2-c]oxazol-3(1H)-one
2(1H)-isoquinolinecarboxamide, N-[(1S)-2-(cyclopentylamino)-1-methyl-2-oxoethyl]-3,4-dihydro-6,7-dimethoxy-1-(4-methoxyphenyl)-
[1,2,4]triazolo[4,3-a]quinoline, 1-(2,4-dimethoxyphenyl)-
| Title | Journal or Book | Year |
|---|---|---|
| Application of LC-NMR to the identification of bulk drug impurities in NK1 antagonist GW597599 (vestipitant) | Magnetic Resonance in Chemistry | 2010 |
KnowItAll NMR Spectral Library
Author: Wiley
The KnowItAll NMR Spectral Library offers a comprehensive collection of NMR reference spectra, including NMR, CNMR, and XNMR, and covers a wide range of compounds including organics, polymers, monomers, metabolites, and more. Learn more.