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5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione, 2-(4-bromophenyl)tetrahydro-9-(4-methoxyphenyl)-
SpectraBase Compound ID DLpao1wPwNa
InChI InChI=1S/C21H20BrN3O3/c1-28-16-9-3-13(4-10-16)18-17-19(24-12-2-11-23(18)24)21(27)25(20(17)26)15-7-5-14(22)6-8-15/h3-10,17-19H,2,11-12H2,1H3
InChIKey ALKCFVQKXGUQPN-UHFFFAOYSA-N
Mol Weight 442.31 g/mol
Molecular Formula C21H20BrN3O3
Exact Mass 441.068805 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BfOnJOcG4xF
Name 5H-pyrazolo[1,2-a]pyrrolo[3,4-c]pyrazole-1,3(2H,3aH)-dione, 2-(4-bromophenyl)tetrahydro-9-(4-methoxyphenyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 441.068804513 u
Formula C21H20BrN3O3
InChI InChI=1S/C21H20BrN3O3/c1-28-16-9-3-13(4-10-16)18-17-19(24-12-2-11-23(18)24)21(27)25(20(17)26)15-7-5-14(22)6-8-15/h3-10,17-19H,2,11-12H2,1H3
InChIKey ALKCFVQKXGUQPN-UHFFFAOYSA-N
Molecular Weight 442.313 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4079
Solvent DMSO-d6
Source Vendor ID: NMR/9244795; Lab Info: LD; Lab Number: LD-P000044
Temperature 29.85 °C