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Ethyl (1.beta.,2.alpha.,3.beta.)-4-methylene-2-phenyl-3-(phenylsulfonyl)cyclopentanecarboxylate
SpectraBase Compound ID A0XftvKzcfK
InChI InChI=1S/C21H22O4S/c1-3-25-21(22)18-14-15(2)20(19(18)16-10-6-4-7-11-16)26(23,24)17-12-8-5-9-13-17/h4-13,18-20H,2-3,14H2,1H3/t18-,19+,20+/m0/s1
InChIKey RTYKBQNZISJRIE-XUVXKRRUSA-N
Mol Weight 370.46 g/mol
Molecular Formula C21H22O4S
Exact Mass 370.12388 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID h6Pq0TWRdX
Name Ethyl (1.beta.,2.alpha.,3.beta.)-4-methylene-2-phenyl-3-(phenylsulfonyl)cyclopentanecarboxylate
Alternate Name(s) Ethyl (1S,2R,3R)-4-methylene-2-phenyl-3-(phenylsulfonyl)cyclopentanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22O4S
InChI InChI=1S/C21H22O4S/c1-3-25-21(22)18-14-15(2)20(19(18)16-10-6-4-7-11-16)26(23,24)17-12-8-5-9-13-17/h4-13,18-20H,2-3,14H2,1H3/t18-,19+,20+/m0/s1
InChIKey RTYKBQNZISJRIE-XUVXKRRUSA-N
Molecular Weight 370.463 g/mol
SMILES [C@]1(S(=O)(=O)c2ccccc2)(C(C[C@@]([C@]1(c1ccccc1)[H])(C(=O)OCC)[H])=C)[H]
SPLASH splash10-0a6r-0960000000-6dd1d285776cd101ab44
Source of Spectrum J-61-4964-4
Wiley ID 1354301