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6-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(3-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile

View entire compound with spectra: 1 NMR

6-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(3-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SpectraBase Compound ID AQAKqYCCGfx
InChI InChI=1S/C21H17BrN4O4/c1-28-12-5-3-4-10(6-12)18-17-16(11-7-14(22)19(27)15(8-11)29-2)13(9-23)20(24)30-21(17)26-25-18/h3-8,16,27H,24H2,1-2H3,(H,25,26)
InChIKey GFIUKVKERJJBJH-UHFFFAOYSA-N
Mol Weight 469.3 g/mol
Molecular Formula C21H17BrN4O4
Exact Mass 468.043318 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID EmNAZP53bTk
Name 6-amino-4-(3-bromo-4-hydroxy-5-methoxyphenyl)-3-(3-methoxyphenyl)-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
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/C21H17BrN4O4/c1-28-12-5-3-4-10(6-12)18-17-16(11-7-14(22)19(27)15(8-11)29-2)13(9-23)20(24)30-21(17)26-25-18/h3-8,16,27H,24H2,1-2H3,(H,25,26)
InChIKey GFIUKVKERJJBJH-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_28801
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: D90089; Labnumber: MROZ-0558; SBI_ID: SBI-028805
Temperature 306 °C