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(3S,4S)-4-[1-(4-Acetyphenyl)ethenyl]-1-[(4-methylphenyl)sulfonyl]-3-pyrrolidinol

View entire compound with spectra: 1 MS (GC)

(3S,4S)-4-[1-(4-Acetyphenyl)ethenyl]-1-[(4-methylphenyl)sulfonyl]-3-pyrrolidinol
SpectraBase Compound ID GuRraWJJC75
InChI InChI=1S/C21H23NO4S/c1-14-4-10-19(11-5-14)27(25,26)22-12-20(21(24)13-22)15(2)17-6-8-18(9-7-17)16(3)23/h4-11,20-21,24H,2,12-13H2,1,3H3/t20-,21-/m1/s1
InChIKey JVTNUTUTJLONEY-NHCUHLMSSA-N
Mol Weight 385.48 g/mol
Molecular Formula C21H23NO4S
Exact Mass 385.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ikYsnHZM78
Name (3S,4S)-4-[1-(4-Acetyphenyl)ethenyl]-1-[(4-methylphenyl)sulfonyl]-3-pyrrolidinol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO4S
InChI InChI=1S/C21H23NO4S/c1-14-4-10-19(11-5-14)27(25,26)22-12-20(21(24)13-22)15(2)17-6-8-18(9-7-17)16(3)23/h4-11,20-21,24H,2,12-13H2,1,3H3/t20-,21-/m1/s1
InChIKey JVTNUTUTJLONEY-NHCUHLMSSA-N
Literature Reference DOI 10.1021/ol702966j
Molecular Weight 385.478 g/mol
SMILES O[C@]1([C@@](C(c2ccc(cc2)C(=O)C)=C)(CN(S(c2ccc(cc2)C)(=O)=O)C1)[H])[H]
SPLASH splash10-001l-6693000000-9ab0a9da93964aae7802
Source of Spectrum A1-10-1047/SMS17-2aB
Synonyms 1-(4-(1-((3S,4S)-4-hydroxy-1-tosylpyrrolidin-3-yl)vinyl)phenyl)ethanone 1-[4-[1-[(3S,4S)-4-hydroxy-1-(4-methylphenyl)sulfonyl-3-pyrrolidinyl]ethenyl]phenyl]ethanone 1-[4-[1-[(3S,4S)-4-hydroxy-1-(4-methylphenyl)sulfonylpyrrolidin-3-yl]ethenyl]phenyl]ethanone 1-[4-[1-[(3S,4S)-4-hydroxy-1-(p-tolylsulfonyl)pyrrolidin-3-yl]vinyl]phenyl]ethanone 1-[4-[1-[(3S,4S)-1-(4-methylphenyl)sulfonyl-4-oxidanyl-pyrrolidin-3-yl]ethenyl]phenyl]ethanone
Wiley ID 1759102