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(+/-)-(3R,4S)-3-Ethenyl-4-(4-phenylphenyl-1-yl)carbonyl-1-[(4-methylphenyl)sulfo- nyl]pyrrolidine
SpectraBase Compound ID CmGgjDmC7kC
InChI InChI=1S/C26H25NO3S/c1-3-20-17-27(31(29,30)24-15-9-19(2)10-16-24)18-25(20)26(28)23-13-11-22(12-14-23)21-7-5-4-6-8-21/h3-16,20,25H,1,17-18H2,2H3/t20-,25+/m1/s1
InChIKey GPFRBCAXVGDKGB-NLFFAJNJSA-N
Mol Weight 431.55 g/mol
Molecular Formula C26H25NO3S
Exact Mass 431.155515 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B0r2YuG9go4
Name (+/-)-(3R,4S)-3-Ethenyl-4-(4-phenylphenyl-1-yl)carbonyl-1-[(4-methylphenyl)sulfo- nyl]pyrrolidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H25NO3S
InChI InChI=1S/C26H25NO3S/c1-3-20-17-27(31(29,30)24-15-9-19(2)10-16-24)18-25(20)26(28)23-13-11-22(12-14-23)21-7-5-4-6-8-21/h3-16,20,25H,1,17-18H2,2H3/t20-,25+/m1/s1
InChIKey GPFRBCAXVGDKGB-NLFFAJNJSA-N
Literature Reference DOI 10.1021/jo101148e
Molecular Weight 431.550 g/mol
SMILES C1[C@@]([C@@](CN1S(c1ccc(cc1)C)(=O)=O)(C=C)[H])(C(=O)c1ccc(-c2ccccc2)cc1)[H]
SPLASH splash10-0fai-2960000000-cf44d046f55f54f0a310
Source of Spectrum J-75-6031/SM6-2c
Synonyms [1,1'-biphenyl]-4-yl((3R,4S)-1-tosyl-4-vinylpyrrolidin-3-yl)methanone
Wiley ID 1751753