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2-bromo-4-[(Z)-(7-bromo-3-oxo[1,3]thiazolo[2',3':2,3]imidazo[4,5-b]pyridin-2(3H)-ylidene)methyl]-6-methoxyphenyl acetate
SpectraBase Compound ID IPiTALsoJwW
InChI InChI=1S/C18H11Br2N3O4S/c1-8(24)27-15-11(20)3-9(4-13(15)26-2)5-14-17(25)23-16-12(22-18(23)28-14)6-10(19)7-21-16/h3-7H,1-2H3/b14-5-
InChIKey ZASLFRPMONTTQL-RZNTYIFUSA-N
Mol Weight 525.17 g/mol
Molecular Formula C18H11Br2N3O4S
Exact Mass 522.883703 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2I8gVKkdqJo
Name 2-bromo-4-[(Z)-(7-bromo-3-oxo[1,3]thiazolo[2',3':2,3]imidazo[4,5-b]pyridin-2(3H)-ylidene)methyl]-6-methoxyphenyl acetate
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 522.883703016 u
Formula C18H11Br2N3O4S
InChI InChI=1S/C18H11Br2N3O4S/c1-8(24)27-15-11(20)3-9(4-13(15)26-2)5-14-17(25)23-16-12(22-18(23)28-14)6-10(19)7-21-16/h3-7H,1-2H3/b14-5-
InChIKey ZASLFRPMONTTQL-RZNTYIFUSA-N
Molecular Weight 525.171 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_993
Solvent DMSO-d6
Source Vendor ID: NMR/12269054