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6-amino-4-{5-[(2-bromophenoxy)methyl]-2,4-dimethylphenyl}-3-methyl-1,4-dihydropyrano[2,3-c]pyrazole-5-carbonitrile
SpectraBase Compound ID AzFgAogqbmo
InChI InChI=1S/C23H21BrN4O2/c1-12-8-13(2)16(9-15(12)11-29-19-7-5-4-6-18(19)24)21-17(10-25)22(26)30-23-20(21)14(3)27-28-23/h4-9,21H,11,26H2,1-3H3,(H,27,28)
InChIKey MXLFGMHIFCMGDO-UHFFFAOYSA-N
Mol Weight 465.35 g/mol
Molecular Formula C23H21BrN4O2
Exact Mass 464.084789 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CKZZOUTHusH
Name 6-amino-4-{5-[(2-bromophenoxy)methyl]-2,4-dimethylphenyl}-3-methyl-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/C23H21BrN4O2/c1-12-8-13(2)16(9-15(12)11-29-19-7-5-4-6-18(19)24)21-17(10-25)22(26)30-23-20(21)14(3)27-28-23/h4-9,21H,11,26H2,1-3H3,(H,27,28)
InChIKey MXLFGMHIFCMGDO-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_14246
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/1011366; UBI_ID: UBI-014249
Temperature 308 °C