For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

6,8-DIMETHYL-8-METHOXYCARBONYLMETHYL-2-MORPHOLINO-5,6,8,9-TETRAHYDRO-[1,2,4]-TRIAZOLO-[1,5-D]-[1,2,4,6]-TETRAZEPINE-5-(7H)-THIONE

View entire compound with spectra: 1 NMR

6,8-DIMETHYL-8-METHOXYCARBONYLMETHYL-2-MORPHOLINO-5,6,8,9-TETRAHYDRO-[1,2,4]-TRIAZOLO-[1,5-D]-[1,2,4,6]-TETRAZEPINE-5-(7H)-THIONE
SpectraBase Compound ID 7fImdvzvFlY
InChI InChI=1S/C13H21N7O3S/c1-13(8-9(21)22-3)15-10-14-11(19-4-6-23-7-5-19)16-20(10)12(24)18(2)17-13/h17H,4-8H2,1-3H3,(H,14,15,16)
InChIKey KMZPSYVIPUQEOD-UHFFFAOYSA-N
Mol Weight 355.42 g/mol
Molecular Formula C13H21N7O3S
Exact Mass 355.142659 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID BEPvZ8Mg1HC
Name 6,8-DIMETHYL-8-METHOXYCARBONYLMETHYL-2-MORPHOLINO-5,6,8,9-TETRAHYDRO-[1,2,4]-TRIAZOLO-[1,5-D]-[1,2,4,6]-TETRAZEPINE-5-(7H)-THIONE
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H21N7O3S
InChI InChI=1S/C13H21N7O3S/c1-13(8-9(21)22-3)15-10-14-11(19-4-6-23-7-5-19)16-20(10)12(24)18(2)17-13/h17H,4-8H2,1-3H3,(H,14,15,16)
InChIKey KMZPSYVIPUQEOD-UHFFFAOYSA-N
Literature Reference Author J.REITER,J.BARKOCZY,I.PALLAGI
Literature Reference Citation J.HETCYCL.CHEM.,30,1325(1993)
Literature Reference DOI 10.1002/jhet.5570300524
Molecular Weight 355.415 g/mol
Solvent DMSO-D6
Source File Reference UWGE877