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(+/-)-(3RS,4Z,6SR)-4-METHYL-6-(METHYLSULFONYL)-1-PHENYL-3-[(SR)-1-(2,4,6-TRIISOPROPYLPHENYL)-ETHOXY]-HEPT-4-EN-1-ONE
SpectraBase Compound ID A0ynjYE6f9g
InChI InChI=1S/C32H46O4S/c1-20(2)27-17-28(21(3)4)32(29(18-27)22(5)6)25(9)36-31(23(7)16-24(8)37(10,34)35)19-30(33)26-14-12-11-13-15-26/h11-18,20-22,24-25,31H,19H2,1-10H3/b23-16-/t24?,25?,31-/m0/s1
InChIKey UYUFXRVKVJQUMS-TZWWRJGPSA-N
Mol Weight 526.8 g/mol
Molecular Formula C32H46O4S
Exact Mass 526.311681 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BCQYqfXzvrb
Name (+/-)-(3RS,4Z,6SR)-4-METHYL-6-(METHYLSULFONYL)-1-PHENYL-3-[(SR)-1-(2,4,6-TRIISOPROPYLPHENYL)-ETHOXY]-HEPT-4-EN-1-ONE
Compound Number 91
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H46O4S
InChI InChI=1S/C32H46O4S/c1-20(2)27-17-28(21(3)4)32(29(18-27)22(5)6)25(9)36-31(23(7)16-24(8)37(10,34)35)19-30(33)26-14-12-11-13-15-26/h11-18,20-22,24-25,31H,19H2,1-10H3/b23-16-/t24?,25?,31-/m0/s1
InChIKey UYUFXRVKVJQUMS-TZWWRJGPSA-N
Literature Reference Author V.NARKEVITCH,S.MEGEVAND,K.SCHENK,P.VOGEL
Literature Reference Citation J.ORG.CHEM.,66,5080(2001)
Literature Reference DOI 10.1021/jo0101712
Molecular Weight 526.775 g/mol
Solvent CDCl3
Source File Reference UWLU27153