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JTDRORGQCPOPLU-UHFFFAOYSA-N
SpectraBase Compound ID 8WROKHiJuGB
InChI InChI=1S/C16H13BrN2O3S/c17-14-11-18-19(23(21,22)13-9-5-2-6-10-13)15(14)16(20)12-7-3-1-4-8-12/h1-11,16,20H
InChIKey JTDRORGQCPOPLU-UHFFFAOYSA-N
Mol Weight 393.26 g/mol
Molecular Formula C16H13BrN2O3S
Exact Mass 391.983026 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1WKDnLmyb5b
Name JTDRORGQCPOPLU-UHFFFAOYSA-N
Compound Number 1155
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H13BrN2O3S
InChI InChI=1S/C16H13BrN2O3S/c17-14-11-18-19(23(21,22)13-9-5-2-6-10-13)15(14)16(20)12-7-3-1-4-8-12/h1-11,16,20H
InChIKey JTDRORGQCPOPLU-UHFFFAOYSA-N
Literature Reference Author M.BEGTRUP,G.BOYER,P.CABILDO,C.CATIVIELA,R.M.CLARAMUNT,J.ELGU ERO,J.I.GARCIA,C.TOI
Literature Reference Citation MAGN.RES.CHEM.,31,107(1993)
Literature Reference DOI 10.1002/mrc.1260310202
Molecular Weight 393.255 g/mol
Solvent DMSO-D6
Source File Reference UWVP1903