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GQVSUTHJPABIAS-UHFFFAOYSA-N

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GQVSUTHJPABIAS-UHFFFAOYSA-N
SpectraBase Compound ID 7WGgsP0D3op
InChI InChI=1S/C12H13BrS3/c1-2-3-7-14-9-6-8-15-12(9)10-4-5-11(13)16-10/h4-6,8H,2-3,7H2,1H3
InChIKey GQVSUTHJPABIAS-UHFFFAOYSA-N
Mol Weight 333.32 g/mol
Molecular Formula C12H13BrS3
Exact Mass 331.936277 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dr0MlscqdXd
Name GQVSUTHJPABIAS-UHFFFAOYSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H13BrS3
InChI InChI=1S/C12H13BrS3/c1-2-3-7-14-9-6-8-15-12(9)10-4-5-11(13)16-10/h4-6,8H,2-3,7H2,1H3
InChIKey GQVSUTHJPABIAS-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 333.319 g/mol
Source File Reference MHKO16542