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((5R),7(Z))-8-Methyl-5-(methylethenyl)-2-phenylsulfenyl-11-tosyloxydec-7-en-3-one
SpectraBase Compound ID 3dvCUtrNLAq
InChI InChI=1S/C28H36O4S2/c1-21(2)25(20-28(29)24(5)33-26-11-7-6-8-12-26)16-13-22(3)10-9-19-32-34(30,31)27-17-14-23(4)15-18-27/h6-8,11-15,17-18,24-25H,1,9-10,16,19-20H2,2-5H3/b22-13-/t24?,25-/m1/s1
InChIKey ITTJWOUIUJZRPE-SRWYCMJSSA-N
Mol Weight 500.7 g/mol
Molecular Formula C28H36O4S2
Exact Mass 500.205502 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3CUoGx09MM5
Name ((5R),7(Z))-8-Methyl-5-(methylethenyl)-2-phenylsulfenyl-11-tosyloxydec-7-en-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H36O4S2
InChI InChI=1S/C28H36O4S2/c1-21(2)25(20-28(29)24(5)33-26-11-7-6-8-12-26)16-13-22(3)10-9-19-32-34(30,31)27-17-14-23(4)15-18-27/h6-8,11-15,17-18,24-25H,1,9-10,16,19-20H2,2-5H3/b22-13-/t24?,25-/m1/s1
InChIKey ITTJWOUIUJZRPE-SRWYCMJSSA-N
Molecular Weight 500.712 g/mol
SMILES c1(S(=O)(=O)OCCC\C(=C/C[C@](CC(C(Sc2ccccc2)C)=O)(C(=C)C)[H])C)ccc(cc1)C
SPLASH splash10-007a-9807000000-e8ad067f12b3547e918e
Source of Spectrum F-48-40-1a
Synonyms ((5R),7(Z))-8-Methyl-5-(methylethenyl)-2-phenylsulfanyl-11-tosyloxydec-7-en-3-one
Wiley ID 1398883