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4-chloro-2-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]phenol
SpectraBase Compound ID LqWArEzVETq
InChI InChI=1S/C16H13ClN2O2/c1-21-12-5-2-10(3-6-12)14-9-15(19-18-14)13-8-11(17)4-7-16(13)20/h2-9,20H,1H3,(H,18,19)
InChIKey ZKDKXGDQMJMUTD-UHFFFAOYSA-N
Mol Weight 300.74 g/mol
Molecular Formula C16H13ClN2O2
Exact Mass 300.066555 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 603AZ9Lb2Mr
Name 4-Chloro-2-[5-(4-methoxyphenyl)-1H-pyrazol-3-yl]phenol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.066555365 u
Formula C16H13ClN2O2
InChI InChI=1S/C16H13ClN2O2/c1-21-12-5-2-10(3-6-12)14-9-15(19-18-14)13-8-11(17)4-7-16(13)20/h2-9,20H,1H3,(H,18,19)
InChIKey ZKDKXGDQMJMUTD-UHFFFAOYSA-N
Molecular Weight 300.745 g/mol
SMILES N1C(=CC(C2=C(C=CC(=C2)Cl)O)=N1)C=1C=CC(=CC1)OC
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