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9-BENZYL-2-MORPHOLINO-6,7,8-TRIMETHYL-5,6,7,8-TETRAHYDRO-[1,2,4]-TRIAZOLO-[1,5-D]-[1,2,4,6]-TETRAZEPINE-5-(9H)-THIONE
SpectraBase Compound ID ANHsr8QMntP
InChI InChI=1S/C18H25N7OS/c1-14-21(2)22(3)18(27)25-17(24(14)13-15-7-5-4-6-8-15)19-16(20-25)23-9-11-26-12-10-23/h4-8,14H,9-13H2,1-3H3
InChIKey YDNVURGKXVQSSL-UHFFFAOYSA-N
Mol Weight 387.51 g/mol
Molecular Formula C18H25N7OS
Exact Mass 387.18413 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H4cJOpNQeqp
Name 9-BENZYL-2-MORPHOLINO-6,7,8-TRIMETHYL-5,6,7,8-TETRAHYDRO-[1,2,4]-TRIAZOLO-[1,5-D]-[1,2,4,6]-TETRAZEPINE-5-(9H)-THIONE
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H25N7OS
InChI InChI=1S/C18H25N7OS/c1-14-21(2)22(3)18(27)25-17(24(14)13-15-7-5-4-6-8-15)19-16(20-25)23-9-11-26-12-10-23/h4-8,14H,9-13H2,1-3H3
InChIKey YDNVURGKXVQSSL-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 387.503 g/mol
Solvent CDCl3
Source File Reference UWGE795