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5-Methoxy-2,2-dimethyl-6-phenyl-6-(phenylthio)-3-hexanone
SpectraBase Compound ID 2XeC9kIeaxx
InChI InChI=1S/C21H26O2S/c1-21(2,3)19(22)15-18(23-4)20(16-11-7-5-8-12-16)24-17-13-9-6-10-14-17/h5-14,18,20H,15H2,1-4H3
InChIKey DTSBHWGKYAODQG-UHFFFAOYSA-N
Mol Weight 342.5 g/mol
Molecular Formula C21H26O2S
Exact Mass 342.165351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 86HCVmYZZF0
Name 5-Methoxy-2,2-dimethyl-6-phenyl-6-(phenylthio)-3-hexanone
Alternate Name(s) 5-Methoxy-2,2-dimethyl-6-phenyl-6-(phenylsulfanyl)-3-hexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26O2S
InChI InChI=1S/C21H26O2S/c1-21(2,3)19(22)15-18(23-4)20(16-11-7-5-8-12-16)24-17-13-9-6-10-14-17/h5-14,18,20H,15H2,1-4H3
InChIKey DTSBHWGKYAODQG-UHFFFAOYSA-N
Molecular Weight 342.497 g/mol
SMILES C(C(C(C)(C)C)=O)C(C(Sc1ccccc1)c1ccccc1)OC
SPLASH splash10-0a4i-9210000000-7c5c52da6f2520c428c2
Source of Spectrum J-58-586-3
Wiley ID 1336780