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ethanone, 1-[5-[2-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]-4-(3,4-dimethylphenyl)-4,5-dihydro-1-phenyl-1H-1,2,4-triazol-3-yl]-
SpectraBase Compound ID Eq4zTAxKTiI
InChI InChI=1S/C32H30ClN3O3/c1-21-17-18-26(19-22(21)2)35-31(23(3)37)34-36(25-12-6-5-7-13-25)32(35)27-14-10-16-29(38-4)30(27)39-20-24-11-8-9-15-28(24)33/h5-19,32H,20H2,1-4H3
InChIKey YGJRKSZICWLHKC-UHFFFAOYSA-N
Mol Weight 540.1 g/mol
Molecular Formula C32H30ClN3O3
Exact Mass 539.19757 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID OrvtwKMzhA
Name ethanone, 1-[5-[2-[(2-chlorophenyl)methoxy]-3-methoxyphenyl]-4-(3,4-dimethylphenyl)-4,5-dihydro-1-phenyl-1H-1,2,4-triazol-3-yl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 539.197569535 u
Formula C32H30ClN3O3
InChI InChI=1S/C32H30ClN3O3/c1-21-17-18-26(19-22(21)2)35-31(23(3)37)34-36(25-12-6-5-7-13-25)32(35)27-14-10-16-29(38-4)30(27)39-20-24-11-8-9-15-28(24)33/h5-19,32H,20H2,1-4H3
InChIKey YGJRKSZICWLHKC-UHFFFAOYSA-N
Molecular Weight 540.063 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7296
Solvent DMSO-d6
Source Vendor ID: NMR/10222721; Lab Info: LP; Lab Number: LP-3900046
Temperature 29.85 °C