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N-[4-[(1,1'-Biphenyl-4-yl)-2',2'-dimethyl-1',3'-dioxan-5'-yl]-4-(t-butyl)-.alpha.-ethyl-N-methylbenzene-ethanesulfonamide

View entire compound with spectra: 2 MS (GC)

N-[4-[(1,1'-Biphenyl-4-yl)-2',2'-dimethyl-1',3'-dioxan-5'-yl]-4-(t-butyl)-.alpha.-ethyl-N-methylbenzene-ethanesulfonamide
SpectraBase Compound ID KessPdipjL4
InChI InChI=1S/C33H43NO4S/c1-8-29(22-24-14-20-28(21-15-24)32(2,3)4)39(35,36)34(7)30-23-37-33(5,6)38-31(30)27-18-16-26(17-19-27)25-12-10-9-11-13-25/h9-21,29-31H,8,22-23H2,1-7H3
InChIKey OOFSOSUPXODEJN-UHFFFAOYSA-N
Mol Weight 549.8 g/mol
Molecular Formula C33H43NO4S
Exact Mass 549.29128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6XoRCxG9fCQ
Name N-[4-[(1,1'-Biphenyl-4-yl)-2',2'-dimethyl-1',3'-dioxan-5'-yl]-4-(t-butyl)-.alpha.-ethyl-N-methylbenzene-ethanesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C33H43NO4S
InChI InChI=1S/C33H43NO4S/c1-8-29(22-24-14-20-28(21-15-24)32(2,3)4)39(35,36)34(7)30-23-37-33(5,6)38-31(30)27-18-16-26(17-19-27)25-12-10-9-11-13-25/h9-21,29-31H,8,22-23H2,1-7H3
InChIKey OOFSOSUPXODEJN-UHFFFAOYSA-N
Molecular Weight 549.770 g/mol
SMILES C1(N(S(C(Cc2ccc(C(C)(C)C)cc2)CC)(=O)=O)C)C(OC(OC1)(C)C)c1ccc(cc1)-c1ccccc1
SPLASH splash10-052s-1901000000-80bc58bb50b9c2d04f5c
Source of Spectrum H-85-3674-19
Synonyms N-[4-{[(1',1''-Biphenyl-4'-yl)-2,2-dimethyl-1,3-dioxan-5-yl]-(4'''--.alpha.-ethyl-N-methylbenzene)-ethanesulfonamide
Wiley ID 1525102