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BOQVDHJQJUMAFE-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR

BOQVDHJQJUMAFE-UHFFFAOYSA-N
SpectraBase Compound ID FQJzeeWzhqr
InChI InChI=1S/C12H12BrN3O2S/c13-9-2-1-3-10(8-9)18-12-11(14-19-15-12)16-4-6-17-7-5-16/h1-3,8H,4-7H2
InChIKey BOQVDHJQJUMAFE-UHFFFAOYSA-N
Mol Weight 342.21 g/mol
Molecular Formula C12H12BrN3O2S
Exact Mass 340.983361 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4qccxIetsMA
Name BOQVDHJQJUMAFE-UHFFFAOYSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12BrN3O2S
InChI InChI=1S/C12H12BrN3O2S/c13-9-2-1-3-10(8-9)18-12-11(14-19-15-12)16-4-6-17-7-5-16/h1-3,8H,4-7H2
InChIKey BOQVDHJQJUMAFE-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 342.210 g/mol
Source File Reference MHKO3072