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2-[1-acetyl-5-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenol

View entire compound with spectra: 2 NMR

2-[1-acetyl-5-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenol
SpectraBase Compound ID 4urv2Lv3we
InChI InChI=1S/C17H15BrN2O2/c1-11(21)20-16(12-6-8-13(18)9-7-12)10-15(19-20)14-4-2-3-5-17(14)22/h2-9,16,22H,10H2,1H3
InChIKey WKODMFSPVUOZAR-UHFFFAOYSA-N
Mol Weight 359.22 g/mol
Molecular Formula C17H15BrN2O2
Exact Mass 358.031691 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4P1CSdS5mt
Name 2-[1-Acetyl-5-(4-bromophenyl)-4,5-dihydro-1H-pyrazol-3-yl]phenol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 358.031690729 u
Formula C17H15BrN2O2
InChI InChI=1S/C17H15BrN2O2/c1-11(21)20-16(12-6-8-13(18)9-7-12)10-15(19-20)14-4-2-3-5-17(14)22/h2-9,16,22H,10H2,1H3
InChIKey WKODMFSPVUOZAR-UHFFFAOYSA-N
Molecular Weight 359.223 g/mol
SMILES OC=1C(C2=NN(C(C2)C2=CC=C(C=C2)Br)C(=O)C)=CC=CC1