MAJOR-DIASTEREOMER
Compound with spectra: 1 NMR
| SpectraBase Compound ID | HSRijepFUEo |
|---|---|
| InChI | InChI=1S/C35H42F3N3O8S/c1-3-16-34(17-15-23-9-6-5-7-10-23)30(31(45)40-33(20-42,21-43)22-44)29(32(46)49-34)27(4-2)24-11-8-12-26(18-24)41-50(47,48)28-14-13-25(19-39-28)35(36,37)38/h5-14,18-19,27,29-30,41-44H,3-4,15-17,20-22H2,1-2H3,(H,40,45)/t27-,29?,30?,34-/m1/s1 |
| InChIKey | PQMQBIIQUBLHMP-YABRCVSVSA-N |
| Mol Weight | 721.8 g/mol |
| Molecular Formula | C35H42F3N3O8S |
| Exact Mass | 721.264471 g/mol |
| Enantiomer InChIKey | PQMQBIIQUBLHMP-TXCODKSLSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | DMSO |
2H,6H-pyrido[2,1-b][1,3,5]thiadiazine-9-carbonitrile, 3-(3-chloro-2-methylphenyl)-8-(2,4-dimethoxyphenyl)-3,4,7,8-tetrahydro-6-oxo-
14-ALPHA,16-OXIDO-ENT-ISOPIMAR-7-ENE-6-ALPHA,15-ALPHA-DIOL
(1S,5R,7R)-4-oxo-3-(1-phenylethyl)-10-oxa-3-azatricyclo[5.2.1.0~1,5~]dec-8-ene-6-carboxylic acid
(1R,3R,4S)8-Phenylmenthyl (8S,9R)-8-(3-cyclopentyloxy-4-methoxyphenyl)-6-methyl-1,4-dithia-6-azaspiro[4.4]nonan-9-carboxylate
CP 945,598 HCl
3,9-Epoxy-6'-methoxyruban-2-one
4-[4-(4"-Ethoxycarbonylphenylazo)phenyl]-2,6-(cyclopent-2'-en-1',4'-diyl)-4-aza-10-oxa-tricyclo[5.2.1.0(2,6)decane
15,16-EPOXY-3-ALPHA,6-BETA,9-ALPHA-TRIHYDROXY-LABDA-13(16),14-DIEN-7-ONE
1,7-Diazaspiro[4.5]decane-3,4-dicarboxylic acid, 6-oxo-2-phenyl-, dimethyl ester, (2.alpha.,3.beta.,4.alpha.,5.alpha.)-(.+-.)-
15,16-DIOXO-16-METHOXY-15,16-SECO-ENT-BEYERAN-19-OIC_ACID
| Title | Journal or Book | Year |
|---|---|---|
| Structure elucidation and total synthesis of a unique group of trace impurities in Tipranavir® drug product | Magnetic Resonance in Chemistry | 2005 |
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.