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Piperazine, 1-(4-tert-butylbenzoyl)-4-(4-fluorophenyl)-

View entire compound with spectra: 2 NMR, and 1 MS (GC)

Piperazine, 1-(4-tert-butylbenzoyl)-4-(4-fluorophenyl)-
SpectraBase Compound ID 8xs0sDFFdK3
InChI InChI=1S/C21H25FN2O/c1-21(2,3)17-6-4-16(5-7-17)20(25)24-14-12-23(13-15-24)19-10-8-18(22)9-11-19/h4-11H,12-15H2,1-3H3
InChIKey FNOWPNOAMOZEDS-UHFFFAOYSA-N
Mol Weight 340.44 g/mol
Molecular Formula C21H25FN2O
Exact Mass 340.195092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CHIvV6LRd6S
Name Piperazine, 1-(4-tert-butylbenzoyl)-4-(4-fluorophenyl)-
Comments Computed using HOSE algorithm
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Exact Mass 340.195091595 u
Formula C21H25FN2O
InChI InChI=1S/C21H25FN2O/c1-21(2,3)17-6-4-16(5-7-17)20(25)24-14-12-23(13-15-24)19-10-8-18(22)9-11-19/h4-11H,12-15H2,1-3H3
InChIKey FNOWPNOAMOZEDS-UHFFFAOYSA-N
Molecular Weight 340.442 g/mol
SMILES C(N1CCN(C2=CC=C(C=C2)F)CC1)(C1=CC=C(C(C)(C)C)C=C1)=O