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(E)-1-(2-ISOPROPYL-3,4,6-TRIPHENYL-4,5,6,7-TETRAHYDRO-2H-INDAZOL-5-YL)-3-PHENYL-PROPEN-2-ONE
SpectraBase Compound ID 2P6yJZvI4AC
InChI InChI=1S/C37H34N2O/c1-26(2)39-37(30-21-13-6-14-22-30)36-32(38-39)25-31(28-17-9-4-10-18-28)35(34(36)29-19-11-5-12-20-29)33(40)24-23-27-15-7-3-8-16-27/h3-24,26,31,34-35H,25H2,1-2H3/b24-23+
InChIKey QNMYEAUMLLAZOX-WCWDXBQESA-N
Mol Weight 522.7 g/mol
Molecular Formula C37H34N2O
Exact Mass 522.267114 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EUCTpiRi7Rn
Name (E)-1-(2-ISOPROPYL-3,4,6-TRIPHENYL-4,5,6,7-TETRAHYDRO-2H-INDAZOL-5-YL)-3-PHENYL-PROPEN-2-ONE
Compound Number IVA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C37H34N2O
InChI InChI=1S/C37H34N2O/c1-26(2)39-37(30-21-13-6-14-22-30)36-32(38-39)25-31(28-17-9-4-10-18-28)35(34(36)29-19-11-5-12-20-29)33(40)24-23-27-15-7-3-8-16-27/h3-24,26,31,34-35H,25H2,1-2H3/b24-23+
InChIKey QNMYEAUMLLAZOX-WCWDXBQESA-N
Literature Reference Author E.V.BOTVINNIK,A.N.BLANDOV,M.A.KUZNETSOV
Literature Reference Citation RUSS.J.ORG.CHEM.,37,421(2001)
Literature Reference DOI 10.1023/A:1012448911890
Molecular Weight 522.690 g/mol
Solvent CDCl3
Source File Reference UWVN5332