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cis-4-tert-butyl-2-(methylthio)cyclohexanone
SpectraBase Compound ID IRpftRslo0Z
InChI InChI=1S/C11H20OS/c1-11(2,3)8-5-6-9(12)10(7-8)13-4/h8,10H,5-7H2,1-4H3/t8-,10-/m1/s1
InChIKey ARPKFFQSQVKRIG-PSASIEDQSA-N
Mol Weight 200.34 g/mol
Molecular Formula C11H20OS
Exact Mass 200.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5ASGPs7nOzW
Name cis-4-tert-butyl-2-(methylthio)cyclohexanone
Alternate Name(s) (2R,4R)-4-tert-butyl-2-(methylsulfanyl)cyclohexanone
CAS Registry Number 108920-15-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H20OS
InChI InChI=1S/C11H20OS/c1-11(2,3)8-5-6-9(12)10(7-8)13-4/h8,10H,5-7H2,1-4H3/t8-,10-/m1/s1
InChIKey ARPKFFQSQVKRIG-PSASIEDQSA-N
Molecular Weight 200.340 g/mol
SMILES C1([C@@](C[C@@](CC1)(C(C)(C)C)[H])(SC)[H])=O
SPLASH splash10-0udu-9530000000-48b3a17b4083bbee6671
Source of Spectrum J-52-3623-3
Wiley ID 1197682