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3-[1-(Difluoroboryloxy)-13-methyltetradecylidene]-1,5-dimethylpyrrolidine-2,4-dione

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-[1-(Difluoroboryloxy)-13-methyltetradecylidene]-1,5-dimethylpyrrolidine-2,4-dione
SpectraBase Compound ID 9Vowdb1zgfi
InChI InChI=1S/C21H36BF2NO3/c1-16(2)14-12-10-8-6-5-7-9-11-13-15-18(28-22(23)24)19-20(26)17(3)25(4)21(19)27/h16-17H,5-15H2,1-4H3
InChIKey JNWRICVLHUPNBN-UHFFFAOYSA-N
Mol Weight 399.3 g/mol
Molecular Formula C21H36BF2NO3
Exact Mass 399.275631 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3j8UIal2kwu
Name 3-[1-(Difluoroboryloxy)-13-methyltetradecylidene]-1,5-dimethylpyrrolidine-2,4-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.275630516 u
Formula C21H36BF2NO3
InChI InChI=1S/C21H36BF2NO3/c1-16(2)14-12-10-8-6-5-7-9-11-13-15-18(28-22(23)24)19-20(26)17(3)25(4)21(19)27/h16-17H,5-15H2,1-4H3
InChIKey JNWRICVLHUPNBN-UHFFFAOYSA-N
Molecular Weight 399.330 g/mol
SMILES C1(N(C(C(\C1=C\(CCCCCCCCCCCC(C)C)OB(F)F)=O)C)C)=O