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acetamide, N-[4-(aminosulfonyl)phenyl]-2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]-
SpectraBase Compound ID KScSxP9nvWk
InChI InChI=1S/C18H15BrN6O3S2/c1-25-14-7-2-10(19)8-13(14)16-17(25)22-18(24-23-16)29-9-15(26)21-11-3-5-12(6-4-11)30(20,27)28/h2-8H,9H2,1H3,(H,21,26)(H2,20,27,28)
InChIKey BARWPCZVADVFQP-UHFFFAOYSA-N
Mol Weight 507.38 g/mol
Molecular Formula C18H15BrN6O3S2
Exact Mass 505.983044 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Vhz8B9ZQiY
Name acetamide, N-[4-(aminosulfonyl)phenyl]-2-[(8-bromo-5-methyl-5H-[1,2,4]triazino[5,6-b]indol-3-yl)thio]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 505.983043712 u
Formula C18H15BrN6O3S2
InChI InChI=1S/C18H15BrN6O3S2/c1-25-14-7-2-10(19)8-13(14)16-17(25)22-18(24-23-16)29-9-15(26)21-11-3-5-12(6-4-11)30(20,27)28/h2-8H,9H2,1H3,(H,21,26)(H2,20,27,28)
InChIKey BARWPCZVADVFQP-UHFFFAOYSA-N
Molecular Weight 507.381 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_2052
Solvent DMSO-d6
Source Vendor ID: NMR/9216143; Lab Info: L-23; Lab Number: KUL-0000006