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Diflufenican, N-heptafluorobutyryl-

View entire compound with spectra: 1 NMR

Diflufenican, N-heptafluorobutyryl-
SpectraBase Compound ID 6og0IGbZAqO
InChI InChI=1S/C23H10F12N2O3/c24-12-6-7-16(15(25)10-12)37(19(39)20(26,27)22(31,32)23(33,34)35)18(38)14-5-2-8-36-17(14)40-13-4-1-3-11(9-13)21(28,29)30/h1-10H
InChIKey ZRLHPLAWUJIUBX-UHFFFAOYSA-N
Mol Weight 590.32 g/mol
Molecular Formula C23H10F12N2O3
Exact Mass 590.04998 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6A6TU7d2NUN
Name Diflufenican, N-heptafluorobutyryl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 590.049980143 u
Formula C23H10F12N2O3
InChI InChI=1S/C23H10F12N2O3/c24-12-6-7-16(15(25)10-12)37(19(39)20(26,27)22(31,32)23(33,34)35)18(38)14-5-2-8-36-17(14)40-13-4-1-3-11(9-13)21(28,29)30/h1-10H
InChIKey ZRLHPLAWUJIUBX-UHFFFAOYSA-N
Molecular Weight 590.325 g/mol
SMILES C(N(C(C(C(F)(F)C(F)(F)F)(F)F)=O)C1=C(F)C=C(C=C1)F)(C1=CC=CN=C1OC=1C=C(C=CC1)C(F)(F)F)=O