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5-(2,6-dimethylphenyl)-1-{2-[3-(2,4-dimethylphenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
SpectraBase Compound ID 9jZyj6Vq4cr
InChI InChI=1S/C32H32N6O4/c1-18-9-14-24(21(4)15-18)25-16-26(22-10-12-23(42-5)13-11-22)38(34-25)27(39)17-36-30-28(33-35-36)31(40)37(32(30)41)29-19(2)7-6-8-20(29)3/h6-15,26,28,30H,16-17H2,1-5H3
InChIKey QVDUJTSXJRFCSX-UHFFFAOYSA-N
Mol Weight 564.6 g/mol
Molecular Formula C32H32N6O4
Exact Mass 564.248504 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 93qeSeYdGQt
Name 5-(2,6-dimethylphenyl)-1-{2-[3-(2,4-dimethylphenyl)-5-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3a,6a-dihydropyrrolo[3,4-d][1,2,3]triazole-4,6(1H,5H)-dione
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C32H32N6O4/c1-18-9-14-24(21(4)15-18)25-16-26(22-10-12-23(42-5)13-11-22)38(34-25)27(39)17-36-30-28(33-35-36)31(40)37(32(30)41)29-19(2)7-6-8-20(29)3/h6-15,26,28,30H,16-17H2,1-5H3
InChIKey QVDUJTSXJRFCSX-UHFFFAOYSA-N
NMR Offset 17.5285
NMR Spectrometer Frequency 500.138
Observed nucleus 1H
Origin 1H_UBI_21270_14711
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: UZI/1020027; UBI_ID: UBI-014714
Temperature 300 °C