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S-PHENYLTHIO-3-METHYL-3,5-DIPHENYLPENT-4-YNOATE

View entire compound with spectra: 1 NMR

S-PHENYLTHIO-3-METHYL-3,5-DIPHENYLPENT-4-YNOATE
SpectraBase Compound ID 2Anz4MuBrRY
InChI InChI=1S/C24H20OS/c1-24(21-13-7-3-8-14-21,18-17-20-11-5-2-6-12-20)19-23(25)26-22-15-9-4-10-16-22/h2-16H,19H2,1H3
InChIKey VDWJVBYVPGJVRL-UHFFFAOYSA-N
Mol Weight 356.48 g/mol
Molecular Formula C24H20OS
Exact Mass 356.123486 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Xvnr3nwY3g
Name S-PHENYLTHIO-3-METHYL-3,5-DIPHENYLPENT-4-YNOATE
Compound Number 6AE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H20OS
InChI InChI=1S/C24H20OS/c1-24(21-13-7-3-8-14-21,18-17-20-11-5-2-6-12-20)19-23(25)26-22-15-9-4-10-16-22/h2-16H,19H2,1H3
InChIKey VDWJVBYVPGJVRL-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 356.482 g/mol
Sample ID 34068
Solvent CDCl3