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1-THIOPHENOXYCARBONYLMETHYL-1-(2-PHENYLETHYNYL)-CYCLOHEXANE

View entire compound with spectra: 1 NMR

1-THIOPHENOXYCARBONYLMETHYL-1-(2-PHENYLETHYNYL)-CYCLOHEXANE
SpectraBase Compound ID 8wo4RNwd6yF
InChI InChI=1S/C22H22OS/c23-21(24-20-12-6-2-7-13-20)18-22(15-8-3-9-16-22)17-14-19-10-4-1-5-11-19/h1-2,4-7,10-13H,3,8-9,15-16,18H2
InChIKey OZMXGXDKPMDNPH-UHFFFAOYSA-N
Mol Weight 334.48 g/mol
Molecular Formula C22H22OS
Exact Mass 334.139137 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2iAes6N82nv
Name 1-THIOPHENOXYCARBONYLMETHYL-1-(2-PHENYLETHYNYL)-CYCLOHEXANE
Compound Number 6FE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22OS
InChI InChI=1S/C22H22OS/c23-21(24-20-12-6-2-7-13-20)18-22(15-8-3-9-16-22)17-14-19-10-4-1-5-11-19/h1-2,4-7,10-13H,3,8-9,15-16,18H2
InChIKey OZMXGXDKPMDNPH-UHFFFAOYSA-N
Literature Reference Author I.MATSUDA,K.I.KOMORI,K.ITOH
Literature Reference Citation J.AM.CHEM.SOC.,124,9072(2002)
Literature Reference DOI 10.1021/ja0264089
Molecular Weight 334.476 g/mol
Sample ID 34077
Solvent CDCl3