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SQ;3-[3,5-BIS-(TRIFLUOROMETHYL)-PHENYLAMINO]-4-METHOXYCYCLOBUT-3-ENE-1,2-DIONE

View entire compound with spectra: 1 NMR

SQ;3-[3,5-BIS-(TRIFLUOROMETHYL)-PHENYLAMINO]-4-METHOXYCYCLOBUT-3-ENE-1,2-DIONE
SpectraBase Compound ID JM06XVDztP9
InChI InChI=1S/C32H28F6N4O3/c1-3-16-15-42-9-7-17(16)10-25(42)26(22-6-8-39-24-5-4-21(45-2)14-23(22)24)41-28-27(29(43)30(28)44)40-20-12-18(31(33,34)35)11-19(13-20)32(36,37)38/h3-6,8,11-14,16-17,25-26,40-41H,1,7,9-10,15H2,2H3/t16?,17?,25?,26-/m0/s1
InChIKey RWVDHFLTDHDJKH-STGLZICKSA-N
Mol Weight 630.6 g/mol
Molecular Formula C32H28F6N4O3
Exact Mass 630.20656 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F6tV3O6CurG
Name SQ;3-[3,5-BIS-(TRIFLUOROMETHYL)-PHENYLAMINO]-4-METHOXYCYCLOBUT-3-ENE-1,2-DIONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H28F6N4O3
InChI InChI=1S/C32H28F6N4O3/c1-3-16-15-42-9-7-17(16)10-25(42)26(22-6-8-39-24-5-4-21(45-2)14-23(22)24)41-28-27(29(43)30(28)44)40-20-12-18(31(33,34)35)11-19(13-20)32(36,37)38/h3-6,8,11-14,16-17,25-26,40-41H,1,7,9-10,15H2,2H3/t16?,17?,25?,26-/m0/s1
InChIKey RWVDHFLTDHDJKH-STGLZICKSA-N
Literature Reference Author K.ZHANG,X.LIANG,M.HE,J.WU,Y.ZHANG,W.XUE,L.JIN,S.YANG,D.HU
Literature Reference Citation MOLECULES,18,6142(2013)
Literature Reference DOI 10.3390/molecules18066142
Solvent CDCl3
Source File Reference UWBT9499