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4-[1-acetyl-3-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-5-yl]phenyl methyl ether

View entire compound with spectra: 2 NMR

4-[1-acetyl-3-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-5-yl]phenyl methyl ether
SpectraBase Compound ID 6c6GdjgFXae
InChI InChI=1S/C18H17BrN2O2/c1-12(22)21-18(14-5-9-16(23-2)10-6-14)11-17(20-21)13-3-7-15(19)8-4-13/h3-10,18H,11H2,1-2H3
InChIKey NBLGDQOVNUSYKN-UHFFFAOYSA-N
Mol Weight 373.25 g/mol
Molecular Formula C18H17BrN2O2
Exact Mass 372.047341 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3xJuoCe6I0g
Name 4-[1-Acetyl-3-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-5-yl]phenyl methyl ether
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 372.047340793 u
Formula C18H17BrN2O2
InChI InChI=1S/C18H17BrN2O2/c1-12(22)21-18(14-5-9-16(23-2)10-6-14)11-17(20-21)13-3-7-15(19)8-4-13/h3-10,18H,11H2,1-2H3
InChIKey NBLGDQOVNUSYKN-UHFFFAOYSA-N
Molecular Weight 373.250 g/mol
SMILES COC1=CC=C(C2N(N=C(C3=CC=C(C=C3)Br)C2)C(=O)C)C=C1