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LGYGVLUGNCZQGP-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR, and 1 MS (GC)

LGYGVLUGNCZQGP-UHFFFAOYSA-N
SpectraBase Compound ID CE0toJWfvmG
InChI InChI=1S/C16H15BrN2O3S/c1-23(21,22)19-14-5-3-2-4-13(14)18-16(20)10-15(19)11-6-8-12(17)9-7-11/h2-9,15H,10H2,1H3,(H,18,20)
InChIKey LGYGVLUGNCZQGP-UHFFFAOYSA-N
Mol Weight 395.27 g/mol
Molecular Formula C16H15BrN2O3S
Exact Mass 393.998677 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 49gHxTcZ9MU
Name LGYGVLUGNCZQGP-UHFFFAOYSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H15BrN2O3S
InChI InChI=1S/C16H15BrN2O3S/c1-23(21,22)19-14-5-3-2-4-13(14)18-16(20)10-15(19)11-6-8-12(17)9-7-11/h2-9,15H,10H2,1H3,(H,18,20)
InChIKey LGYGVLUGNCZQGP-UHFFFAOYSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 395.271 g/mol
Source File Reference MHKO7546