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3-BUTOXYCARBONYL-2,2-BIS-(TRIFLUOROMETHYL)-3,4-DIHYDRO-2H-PYRIMIDO-[2.1-B]-BENZTHIAZOLE
SpectraBase Compound ID 9sfyaqvGiqw
InChI InChI=1S/C17H16F6N2O2S/c1-2-3-8-27-13(26)10-9-25-11-6-4-5-7-12(11)28-14(25)24-15(10,16(18,19)20)17(21,22)23/h4-7,10H,2-3,8-9H2,1H3
InChIKey DLJQUENQOYWJKA-UHFFFAOYSA-N
Mol Weight 426.38 g/mol
Molecular Formula C17H16F6N2O2S
Exact Mass 426.083668 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 49YXSNMPFce
Name 3-BUTOXYCARBONYL-2,2-BIS-(TRIFLUOROMETHYL)-3,4-DIHYDRO-2H-PYRIMIDO-[2.1-B]-BENZTHIAZOLE
Compound Number 30F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H16F6N2O2S
InChI InChI=1S/C17H16F6N2O2S/c1-2-3-8-27-13(26)10-9-25-11-6-4-5-7-12(11)28-14(25)24-15(10,16(18,19)20)17(21,22)23/h4-7,10H,2-3,8-9H2,1H3
InChIKey DLJQUENQOYWJKA-UHFFFAOYSA-N
Literature Reference Author J.CYRENER,K.BURGER
Literature Reference Citation MH.CHEM.,126,319(1995)
Literature Reference DOI 10.1007/BF00816101
Solvent CDCl3
Source File Reference UWMK52