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DITHIOCARBONIC-ACID-S-(1-CYANOMETHYL-3,3,3-TRIFLUOROPROPYL)-ESTER-O-PHENETHYLESTER
SpectraBase Compound ID ETWILqMKtgD
InChI InChI=1S/C14H14F3NOS2/c15-14(16,17)10-12(6-8-18)21-13(20)19-9-7-11-4-2-1-3-5-11/h1-5,12H,6-7,9-10H2
InChIKey HONXUGJNYBVHSP-UHFFFAOYSA-N
Mol Weight 333.39 g/mol
Molecular Formula C14H14F3NOS2
Exact Mass 333.046891 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Evm4jlYIPlU
Name DITHIOCARBONIC-ACID-S-(1-CYANOMETHYL-3,3,3-TRIFLUOROPROPYL)-ESTER-O-PHENETHYLESTER
Compound Number 4H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H14F3NOS2
InChI InChI=1S/C14H14F3NOS2/c15-14(16,17)10-12(6-8-18)21-13(20)19-9-7-11-4-2-1-3-5-11/h1-5,12H,6-7,9-10H2
InChIKey HONXUGJNYBVHSP-UHFFFAOYSA-N
Literature Reference Author F.BERTRAND,V.PEVERE,B.QUICLET-SIRE,S.Z.ZARD
Literature Reference Citation ORG.LETTERS,3,1069(2001)
Literature Reference DOI 10.1021/ol0156446
Molecular Weight 333.386 g/mol
Solvent CDCl3
Source File Reference UWVN32590