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JOUZJTKKJDXTBE-UHFFFAOYSA-N
SpectraBase Compound ID E2Ppr9HiBIQ
InChI InChI=1S/C16H20ClN3O2S/c1-19-11-5-6-12-16(23-10-9-20(12)8-7-17)15(11)18-13(19)3-2-4-14(21)22/h5-6H,2-4,7-10H2,1H3,(H,21,22)
InChIKey JOUZJTKKJDXTBE-UHFFFAOYSA-N
Mol Weight 353.87 g/mol
Molecular Formula C16H20ClN3O2S
Exact Mass 353.096476 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KjOEzWtLOlA
Name 4-[7,8-DIHYDRO-6-(CHLOROETHYLAMINO)-3-METHYL-1,4-THIAZINO-[3,2-G]-BENZIMIDAZOLYL-(2)]-BUTYRIC-ACID
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20ClN3O2S
InChI InChI=1S/C16H20ClN3O2S/c1-19-11-5-6-12-16(23-10-9-20(12)8-7-17)15(11)18-13(19)3-2-4-14(21)22/h5-6H,2-4,7-10H2,1H3,(H,21,22)
InChIKey JOUZJTKKJDXTBE-UHFFFAOYSA-N
Literature Reference Author R.GUST,R.KRAUSER
Literature Reference Citation MH.CHEM.,128,291(1997)
Literature Reference DOI 10.1007/BF00807895
Molecular Weight 353.867 g/mol
Solvent CD3OD
Source File Reference UWCS12707