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Piperazine, 1-(2-fluorobenzoyl)-4-(3,4,5-trimethoxybenzoyl)-
SpectraBase Compound ID AHd0j8VrjJr
InChI InChI=1S/C21H23FN2O5/c1-27-17-12-14(13-18(28-2)19(17)29-3)20(25)23-8-10-24(11-9-23)21(26)15-6-4-5-7-16(15)22/h4-7,12-13H,8-11H2,1-3H3
InChIKey UIEDALKLJHTQLG-UHFFFAOYSA-N
Mol Weight 402.42 g/mol
Molecular Formula C21H23FN2O5
Exact Mass 402.1591 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FpMfOCoIOUJ
Name Piperazine, 1-(2-fluorobenzoyl)-4-(3,4,5-trimethoxybenzoyl)-
Comments Computed using HOSE algorithm
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Exact Mass 402.159100007 u
Formula C21H23FN2O5
InChI InChI=1S/C21H23FN2O5/c1-27-17-12-14(13-18(28-2)19(17)29-3)20(25)23-8-10-24(11-9-23)21(26)15-6-4-5-7-16(15)22/h4-7,12-13H,8-11H2,1-3H3
InChIKey UIEDALKLJHTQLG-UHFFFAOYSA-N
Molecular Weight 402.422 g/mol
SMILES C(C1=C(F)C=CC=C1)(N1CCN(C(C2=CC(OC)=C(C(=C2)OC)OC)=O)CC1)=O