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2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-bromophenyl)acetamide
SpectraBase Compound ID 9XKWLYsrhg
InChI InChI=1S/C18H13Br2N5OS/c1-25-14-7-4-11(20)8-13(14)16-17(25)22-18(24-23-16)27-9-15(26)21-12-5-2-10(19)3-6-12/h2-8H,9H2,1H3,(H,21,26)
InChIKey MPZDYCPUDGLIDP-UHFFFAOYSA-N
Mol Weight 507.2 g/mol
Molecular Formula C18H13Br2N5OS
Exact Mass 504.920757 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5DbwTYsNzaU
Name 2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)sulfanyl]-N-(4-bromophenyl)acetamide
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/C18H13Br2N5OS/c1-25-14-7-4-11(20)8-13(14)16-17(25)22-18(24-23-16)27-9-15(26)21-12-5-2-10(19)3-6-12/h2-8H,9H2,1H3,(H,21,26)
InChIKey MPZDYCPUDGLIDP-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_ASIOH_7529_1011
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: ZI/9015592; Labnumber: KUL-0000045
Temperature 303 °C