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2,7-DIMETHYL-4-(PHENYLTHIO)-OCTA-1,7-DIENE
SpectraBase Compound ID FiICnCdidGP
InChI InChI=1S/C16H22S/c1-13(2)10-11-16(12-14(3)4)17-15-8-6-5-7-9-15/h5-9,16H,1,3,10-12H2,2,4H3
InChIKey VGOQMJCGXSLMCR-UHFFFAOYSA-N
Mol Weight 246.41 g/mol
Molecular Formula C16H22S
Exact Mass 246.144222 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8HCYkzR6khm
Name 2,7-DIMETHYL-4-(PHENYLTHIO)-OCTA-1,7-DIENE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H22S
InChI InChI=1S/C16H22S/c1-13(2)10-11-16(12-14(3)4)17-15-8-6-5-7-9-15/h5-9,16H,1,3,10-12H2,2,4H3
InChIKey VGOQMJCGXSLMCR-UHFFFAOYSA-N
Literature Reference Author J.HARVEY,M.H.BRICHARD,H.G.VIEHE
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2275(1993)
Literature Reference DOI 10.1039/p19930002275
Molecular Weight 246.411 g/mol
Solvent CDCl3
Source File Reference UWRU3392