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Isopropyl 2-methyl-4-[(4'-methylphenyl)sulfonyl]-5-phenylpyrrolidine-2-carboxylate
SpectraBase Compound ID 7lngZQM5cQE
InChI InChI=1S/C22H27NO4S/c1-15(2)27-21(24)22(4)14-19(20(23-22)17-8-6-5-7-9-17)28(25,26)18-12-10-16(3)11-13-18/h5-13,15,19-20,23H,14H2,1-4H3
InChIKey LZODSLVNNMFIEB-UHFFFAOYSA-N
Mol Weight 401.52 g/mol
Molecular Formula C22H27NO4S
Exact Mass 401.16608 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BK0Pb4riXdk
Name Isopropyl 2-methyl-4-[(4'-methylphenyl)sulfonyl]-5-phenylpyrrolidine-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H27NO4S
InChI InChI=1S/C22H27NO4S/c1-15(2)27-21(24)22(4)14-19(20(23-22)17-8-6-5-7-9-17)28(25,26)18-12-10-16(3)11-13-18/h5-13,15,19-20,23H,14H2,1-4H3
InChIKey LZODSLVNNMFIEB-UHFFFAOYSA-N
Molecular Weight 401.521 g/mol
SMILES N1C(CC(C1c1ccccc1)S(c1ccc(cc1)C)(=O)=O)(C(OC(C)C)=O)C
SPLASH splash10-0a4i-2900000000-d644a24f1f046a59c3d9
Source of Spectrum K1-2001-1979-2
Wiley ID 846297