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4,5-DIHYDRO-5-METHYL-1-(N,N-DIMETHYLAMINOMETHYL)-S-TRIAZOLO-[3,4-D]-[1,5]-BENZOTHIAZEPINE;MAJOR-ISOMER
SpectraBase Compound ID FRaPpMZHmY5
InChI InChI=1S/C14H18N4S/c1-10-8-13-15-16-14(9-17(2)3)18(13)11-6-4-5-7-12(11)19-10/h4-7,10H,8-9H2,1-3H3
InChIKey CIGSKZLBOBVMHW-UHFFFAOYSA-N
Mol Weight 274.39 g/mol
Molecular Formula C14H18N4S
Exact Mass 274.125218 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID aa307maah7
Name 4,5-DIHYDRO-5-METHYL-1-(N,N-DIMETHYLAMINOMETHYL)-S-TRIAZOLO-[3,4-D]-[1,5]-BENZOTHIAZEPINE;MINOR-ISOMER
Compound Number 1F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18N4S
InChI InChI=1S/C14H18N4S/c1-10-8-13-15-16-14(9-17(2)3)18(13)11-6-4-5-7-12(11)19-10/h4-7,10H,8-9H2,1-3H3
InChIKey CIGSKZLBOBVMHW-UHFFFAOYSA-N
Literature Reference Author V.AMBROGI,G.GRANDOLINI,L.PERIOLI,M.KAJTAR-PEREDY,L.RADICS
Literature Reference Citation J.HETCYCL.CHEM.,31,1349(1994)
Literature Reference DOI 10.1002/jhet.5570310609
Molecular Weight 274.384 g/mol
Solvent CDCl3
Source File Reference UWCS16614