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1H-benz[de]isoquinoline-1,3(2H)-dione, 6-bromo-2-[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-yl]-
SpectraBase Compound ID K8FUAiVzmiG
InChI InChI=1S/C23H15BrN4O4/c1-12-21(13(2)27(25-12)14-6-8-15(9-7-14)28(31)32)26-22(29)17-5-3-4-16-19(24)11-10-18(20(16)17)23(26)30/h3-11H,1-2H3
InChIKey CONRXYZYPWQQDZ-UHFFFAOYSA-N
Mol Weight 491.3 g/mol
Molecular Formula C23H15BrN4O4
Exact Mass 490.027668 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9X59BqijyIp
Name 1H-benz[de]isoquinoline-1,3(2H)-dione, 6-bromo-2-[3,5-dimethyl-1-(4-nitrophenyl)-1H-pyrazol-4-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 490.027667975 u
Formula C23H15BrN4O4
InChI InChI=1S/C23H15BrN4O4/c1-12-21(13(2)27(25-12)14-6-8-15(9-7-14)28(31)32)26-22(29)17-5-3-4-16-19(24)11-10-18(20(16)17)23(26)30/h3-11H,1-2H3
InChIKey CONRXYZYPWQQDZ-UHFFFAOYSA-N
Molecular Weight 491.301 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_3302
Solvent DMSO-d6
Source Vendor ID: NMR/9278290; Lab Number: BAS 0850631
Temperature 29.85 °C