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p-TOLUENESULFONIC ACID, trans-4-tert-BUTYLCYCLOHEXYL ESTER
SpectraBase Compound ID 1aZWEL1sb52
InChI InChI=1S/C17H26O3S/c1-13-5-11-16(12-6-13)21(18,19)20-15-9-7-14(8-10-15)17(2,3)4/h5-6,11-12,14-15H,7-10H2,1-4H3/t14-,15-
InChIKey JGDVVPFUYCFCOV-SHTZXODSSA-N
Mol Weight 310.45 g/mol
Molecular Formula C17H26O3S
Exact Mass 310.160266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3pa2oLEVTku
Name p-TOLUENESULFONIC ACID, trans-4-tert-BUTYLCYCLOHEXYL ESTER
Source of Sample D. Doddrell, W. Kitching, W. Adcock J. Org. Chem. 41, 3036(1976)
CAS Registry Number 7453-05-6
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H26O3S
InChI InChI=1S/C17H26O3S/c1-13-5-11-16(12-6-13)21(18,19)20-15-9-7-14(8-10-15)17(2,3)4/h5-6,11-12,14-15H,7-10H2,1-4H3/t14-,15-
InChIKey JGDVVPFUYCFCOV-SHTZXODSSA-N
Molecular Weight 310.46
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WH-270
Synonyms P-TOLUENESULFONIC ACID, 4-tert-BUTYLCYCLOHEXYL ESTER, trans-,