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2(S/R)-Benzyl-6-(t-butyl)-2(R/S)-(methylsulfinyl)cyclohexanone
SpectraBase Compound ID CeON86H3uW3
InChI InChI=1S/C18H26O2S/c1-17(2,3)15-11-8-12-18(16(15)19,21(4)20)13-14-9-6-5-7-10-14/h5-7,9-10,15H,8,11-13H2,1-4H3
InChIKey NXAWPMPFFKBFAO-UHFFFAOYSA-N
Mol Weight 306.46 g/mol
Molecular Formula C18H26O2S
Exact Mass 306.165351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2QPeG1zNVtY
Name 2(S/R)-Benzyl-6-(t-butyl)-2(R/S)-(methylsulfinyl)cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O2S
InChI InChI=1S/C18H26O2S/c1-17(2,3)15-11-8-12-18(16(15)19,21(4)20)13-14-9-6-5-7-10-14/h5-7,9-10,15H,8,11-13H2,1-4H3
InChIKey NXAWPMPFFKBFAO-UHFFFAOYSA-N
Molecular Weight 306.464 g/mol
SMILES C1(C(C(C(C)(C)C)CCC1)=O)(S(=O)C)Cc1ccccc1
SPLASH splash10-0a4u-9402000000-1cbe2fcbb860c8347488
Source of Spectrum Y4-88-598-5
Synonyms 2(R/S)-Benzyl-6-(t-butyl)-2(S/R)-(methylsulfinyl)cyclohexanone 2 (R / S)-Benzyl-6-(t-butyl)-2 (S / R)-(methylsulfinyl)-1-cyclohexanone 2 (S / R)-Benzyl-6-(t-butyl)-2 (R / S)-(methylsulfinyl)-1-cyclohexanone 2-Benzyl-6-tert-butyl-2-(methylsulfinyl)cyclohexanone
Wiley ID 1550283