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2,4-ditert-butyl-2-(phenylthio)-1-cyclobutanone
SpectraBase Compound ID BnxYNTYo80I
InChI InChI=1S/C18H26OS/c1-16(2,3)14-12-18(15(14)19,17(4,5)6)20-13-10-8-7-9-11-13/h7-11,14H,12H2,1-6H3
InChIKey JPYBGFLENQUKER-UHFFFAOYSA-N
Mol Weight 290.46 g/mol
Molecular Formula C18H26OS
Exact Mass 290.170437 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5U9czBopCmg
Name 2,4-ditert-butyl-2-(phenylthio)-1-cyclobutanone
Comments Less than 3 mono-isotopic peaks
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Formula C18H26OS
InChI InChI=1S/C18H26OS/c1-16(2,3)14-12-18(15(14)19,17(4,5)6)20-13-10-8-7-9-11-13/h7-11,14H,12H2,1-6H3
InChIKey JPYBGFLENQUKER-UHFFFAOYSA-N
Molecular Weight 290.465 g/mol
SMILES C1(C(=O)C(C1)C(C)(C)C)(Sc1ccccc1)C(C)(C)C
SPLASH splash10-000f-0900000000-a0d613aa66dbb7ada519
Source of Spectrum C-117-4514-21
Synonyms 2,4-ditert-butyl-2-(phenylthio)cyclobutanone 2,4-ditert-butyl-2-phenylsulfanyl-cyclobutan-1-one 2,4-ditert-butyl-2-phenylsulfanylcyclobutan-1-one
Wiley ID 758870