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4H-indazol-4-one, 1-(1H-benzimidazol-2-yl)-1,5,6,7-tetrahydro-6-(2-hydroxyphenyl)-

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4H-indazol-4-one, 1-(1H-benzimidazol-2-yl)-1,5,6,7-tetrahydro-6-(2-hydroxyphenyl)-
SpectraBase Compound ID G7lCN44bLld
InChI InChI=1S/C20H16N4O2/c25-18-8-4-1-5-13(18)12-9-17-14(19(26)10-12)11-21-24(17)20-22-15-6-2-3-7-16(15)23-20/h1-8,11-12,25H,9-10H2,(H,22,23)
InChIKey DSBNIOVNUWNHCB-UHFFFAOYSA-N
Mol Weight 344.37 g/mol
Molecular Formula C20H16N4O2
Exact Mass 344.127326 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5iJ4n8DVig7
Name 4H-Indazol-4-one, 1-(1H-benzimidazol-2-yl)-1,5,6,7-tetrahydro-6-(2-hydroxyphenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.127325769 u
Formula C20H16N4O2
InChI InChI=1S/C20H16N4O2/c25-18-8-4-1-5-13(18)12-9-17-14(19(26)10-12)11-21-24(17)20-22-15-6-2-3-7-16(15)23-20/h1-8,11-12,25H,9-10H2,(H,22,23)
InChIKey DSBNIOVNUWNHCB-UHFFFAOYSA-N
SMILES OC=1C(C2CC(C3=C(N(C4=NC=5C=CC=CC5N4)N=C3)C2)=O)=CC=CC1