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9-BENZYL-6,8-DIMETHYL-2-MORPHOLINO-5,6,7,8-TETRAHYDRO-[1,2,4]-TRIAZOLO-[1,5-D]-[1,2,4,6]-TETRAZEPINE-5-(9H)-THIONE
SpectraBase Compound ID E7UvemmZXtC
InChI InChI=1S/C17H23N7OS/c1-13-19-21(2)17(26)24-16(23(13)12-14-6-4-3-5-7-14)18-15(20-24)22-8-10-25-11-9-22/h3-7,13,19H,8-12H2,1-2H3
InChIKey DAZHFSIDGQULNQ-UHFFFAOYSA-N
Mol Weight 373.48 g/mol
Molecular Formula C17H23N7OS
Exact Mass 373.16848 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 80Z2dYSNKWQ
Name 9-BENZYL-6,8-DIMETHYL-2-MORPHOLINO-5,6,7,8-TETRAHYDRO-[1,2,4]-TRIAZOLO-[1,5-D]-[1,2,4,6]-TETRAZEPINE-5-(9H)-THIONE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H23N7OS
InChI InChI=1S/C17H23N7OS/c1-13-19-21(2)17(26)24-16(23(13)12-14-6-4-3-5-7-14)18-15(20-24)22-8-10-25-11-9-22/h3-7,13,19H,8-12H2,1-2H3
InChIKey DAZHFSIDGQULNQ-UHFFFAOYSA-N
Literature Reference Author J.BARKOCZY,J.REITER
Literature Reference Citation J.HETCYCL.CHEM.,30,1009(1993)
Literature Reference DOI 10.1002/jhet.5570300429
Molecular Weight 373.476 g/mol
Solvent CDCl3
Source File Reference UWGE793