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4-METHYL-6-METHYLCARBONYL-4H,5H,6H-THIAZOLO-[3,2-A]-[1,5]-BENZODIAZEPIN-11-IUM-BROMIDE
SpectraBase Compound ID EHdTZi9bm4l
InChI InChI=1S/C14H15N2OS.BrH/c1-10-9-16(11(2)17)13-6-4-3-5-12(13)15-7-8-18-14(10)15;/h3-8,10H,9H2,1-2H3;1H/q+1;/p-1
InChIKey FPWYYMNNZORGEC-UHFFFAOYSA-M
Mol Weight 339.25 g/mol
Molecular Formula C14H15BrN2OS
Exact Mass 338.008847 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BnYCLEblOqN
Name 4-METHYL-6-METHYLCARBONYL-4H,5H,6H-THIAZOLO-[3,2-A]-[1,5]-BENZODIAZEPIN-11-IUM-BROMIDE
Compound Number 2G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H15BrN2OS
InChI InChI=1S/C14H15N2OS.BrH/c1-10-9-16(11(2)17)13-6-4-3-5-12(13)15-7-8-18-14(10)15;/h3-8,10H,9H2,1-2H3;1H/q+1;/p-1
InChIKey FPWYYMNNZORGEC-UHFFFAOYSA-M
Literature Reference Author R.JANCIENE,Z.STUMBREVICIUTE,D.PODENIENE,B.D.PUODZIUNAITE,S.B LACK,M.HUSBANDS
Literature Reference Citation J.HETCYCL.CHEM.,43,979(2006)
Literature Reference DOI 10.1002/jhet.5570430424
Molecular Weight 339.250 g/mol
Sample ID 67616
Solvent CDCl3