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4-bromo-N-(3,5-dioxo-4-azatetracyclo[5.3.2.0~2,6~.0~8,10~]dodec-11-en-4-yl)-1,5-dimethyl-1H-pyrazole-3-carboxamide
SpectraBase Compound ID N6hN2x1nq
InChI InChI=1S/C17H17BrN4O3/c1-6-13(18)14(19-21(6)2)15(23)20-22-16(24)11-7-3-4-8(10-5-9(7)10)12(11)17(22)25/h3-4,7-12H,5H2,1-2H3,(H,20,23)/t7-,8+,9+,10-,11?,12?
InChIKey GLYFZMQSXUISGI-GEDKWGBFSA-N
Mol Weight 405.25 g/mol
Molecular Formula C17H17BrN4O3
Exact Mass 404.048403 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID INDarmqQLUD
Name 4-bromo-N-(3,5-dioxo-4-azatetracyclo[5.3.2.0~2,6~.0~8,10~]dodec-11-en-4-yl)-1,5-dimethyl-1H-pyrazole-3-carboxamide
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/C17H17BrN4O3/c1-6-13(18)14(19-21(6)2)15(23)20-22-16(24)11-7-3-4-8(10-5-9(7)10)12(11)17(22)25/h3-4,7-12H,5H2,1-2H3,(H,20,23)/t7-,8+,9+,10-,11?,12?
InChIKey GLYFZMQSXUISGI-GEDKWGBFSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12852
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/9317295; UBI_ID: UBI-012855
Temperature 318 °C