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N-[[5-METHOXY-5-(TRIFLUOROMETHYL)-4,5-DIHYDRO-1,3,4-OXADIAZOL-2-YL]-METHYL]-ETHANE-1,2-DIAMINE

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N-[[5-METHOXY-5-(TRIFLUOROMETHYL)-4,5-DIHYDRO-1,3,4-OXADIAZOL-2-YL]-METHYL]-ETHANE-1,2-DIAMINE
SpectraBase Compound ID Ip40anShnDy
InChI InChI=1S/C7H13F3N4O2/c1-15-7(6(8,9)10)14-13-5(16-7)4-12-3-2-11/h12,14H,2-4,11H2,1H3
InChIKey QTHHSWLKVWKBTJ-UHFFFAOYSA-N
Mol Weight 242.2 g/mol
Molecular Formula C7H13F3N4O2
Exact Mass 242.09906 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6Vg5qPJf8jm
Name N-[[5-METHOXY-5-(TRIFLUOROMETHYL)-4,5-DIHYDRO-1,3,4-OXADIAZOL-2-YL]-METHYL]-ETHANE-1,2-DIAMINE
Compound Number 7 A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H13F3N4O2
InChI InChI=1S/C7H13F3N4O2/c1-15-7(6(8,9)10)14-13-5(16-7)4-12-3-2-11/h12,14H,2-4,11H2,1H3
InChIKey QTHHSWLKVWKBTJ-UHFFFAOYSA-N
Literature Reference Author J.BALSELLS,L.DIMICHELE,J.LIU,M.KUBRYK,K.HANSEN,J.D.ARMSTRONG
Literature Reference Citation ORG.LETTERS,7,1039(2005)
Literature Reference DOI 10.1021/ol0474406
Molecular Weight 242.201 g/mol
Sample ID 62239
Solvent CD3OD