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1-PARA-ETHOXYCARBONYLPHENYL-2-(PARA-ETHOXYCARBONYLPHENYLIMINO)-3,3-BIS(TRIFLUOROMETHYL)-4-HEXAFLUOROISOPROPYLIDENEAZETIDINE

View entire compound with spectra: 1 NMR

1-PARA-ETHOXYCARBONYLPHENYL-2-(PARA-ETHOXYCARBONYLPHENYLIMINO)-3,3-BIS(TRIFLUOROMETHYL)-4-HEXAFLUOROISOPROPYLIDENEAZETIDINE
SpectraBase Compound ID 5UmSQstLTxl
InChI InChI=1S/C26H18F12N2O4/c1-3-43-19(41)13-5-9-15(10-6-13)39-21-22(25(33,34)35,26(36,37)38)18(17(23(27,28)29)24(30,31)32)40(21)16-11-7-14(8-12-16)20(42)44-4-2/h5-12H,3-4H2,1-2H3/b39-21-
InChIKey CQCJZRLACXHJDG-XFDYYPNTSA-N
Mol Weight 650.42 g/mol
Molecular Formula C26H18F12N2O4
Exact Mass 650.107495 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8jNbJbWRu8y
Name 1-PARA-ETHOXYCARBONYLPHENYL-2-(PARA-ETHOXYCARBONYLPHENYLIMINO)-3,3-BIS(TRIFLUOROMETHYL)-4-HEXAFLUOROISOPROPYLIDENEAZETIDINE
Comments ERRATA IN BRUTTO-FORMULA: C28H18F12N2O4. 12.50 AND 23.70 WERE;H-60 (HITACHI)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C26H18F12N2O4
InChI InChI=1S/C26H18F12N2O4/c1-3-43-19(41)13-5-9-15(10-6-13)39-21-22(25(33,34)35,26(36,37)38)18(17(23(27,28)29)24(30,31)32)40(21)16-11-7-14(8-12-16)20(42)44-4-2/h5-12H,3-4H2,1-2H3/b39-21-
InChIKey CQCJZRLACXHJDG-XFDYYPNTSA-N
Instrument Name SEE COMMENT
Literature Reference N.P.GAMBARYAN, E.A.AVETISYAN (1976) Izv.Akad.Nauk SSSR(Russ. Lang.): N2, 358-363.
NMR Standard -CF3COOH
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C4H10O diethyl ether