MAJOR-ROTAMER
Compound with spectra: 4 NMR
| SpectraBase Compound ID | E9NBsnjtV4k |
|---|---|
| InChI | InChI=1S/C39H48FN5O4/c1-38(2,3)42-36(47)31-24-43(23-27-14-11-17-41-22-27)18-19-44(31)25-32(46)34(40)30(20-26-12-7-6-8-13-26)37(48)45-35-29-16-10-9-15-28(29)21-33(35)49-39(45,4)5/h6-17,22,30-31,33-35H,18-21,23-25H2,1-5H3,(H,42,47)/t30-,31-,33+,34+,35-/m0/s1 |
| InChIKey | YQLYJJSYWWROHI-LQQUQBBISA-N |
| Mol Weight | 669.8 g/mol |
| Molecular Formula | C39H48FN5O4 |
| Exact Mass | 669.369033 g/mol |
| Enantiomer InChIKey | YQLYJJSYWWROHI-DOMPTNBQSA-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 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
- MINOR-ROTAMER
Tetrahydroberberine-cyanoborane
2-Amino-1-(2-chloro-4-nitro-phenyl)-5-keto-4-(3-thienyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
1-Benzenesulfonyl-2-pentafluorobenzoyl-1H-indole-4,7-dione
ethyl 4-{5-[(4-chlorophenoxy)methyl]-2,4-dimethylphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
7-Methyl-1-(5-methyl-2-furyl)-2,5-diphenylpyrazazolo[4,3-c][1,5.2]diazaphosphinan-3-one
2-Amino-1-(2-fluorophenyl)-5-keto-4-(3-thienyl)-4,6,7,8-tetrahydroquinoline-3-carbonitrile
(3aR,8bR,SS)-N-(tert-Butyloxycarbonyl)-3a,8b-dihydro-7-hydroxy-8-(p-tolylsulfinyl)pyrrolo[3,2-b]benzofuran-2(3H)-one
MICROPEPTIN_HU1041
(3aS,8bS,SS)-N-(tert-Butyloxycarbonyl)-3a,8b-dihydro-7-hydroxy-8-(p-tolylsulfinyl)pyrrolo[3,2-b]benzofuran-2(3H)-one
ethyl 4-(5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dimethylphenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
| Title | Journal or Book | Year |
|---|---|---|
| On the Inherent Instability of α-Amino α‘-Fluoro Ketones. Evidence for Their Transformation to Reactive Oxyvinyliminium Ion Intermediates | Organic Letters | 2001 |
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.