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ETHYL-6-[3-(1H-PYRROL-2-YL)-PENTAN-3-YL]-3-(1-BENZYL-1H-TETRAZOL-5-YL)-4,4A,7,7A-TETRAHYDRO-1H-PYRROLO-[3,2-C]-PYRIDAZINE-1-CARBOXYLATE

View entire compound with spectra: 1 NMR

ETHYL-6-[3-(1H-PYRROL-2-YL)-PENTAN-3-YL]-3-(1-BENZYL-1H-TETRAZOL-5-YL)-4,4A,7,7A-TETRAHYDRO-1H-PYRROLO-[3,2-C]-PYRIDAZINE-1-CARBOXYLATE
SpectraBase Compound ID GDzPHZRHK7l
InChI InChI=1S/C26H32N8O2/c1-4-26(5-2,22-13-10-14-27-22)23-16-21-19(28-23)15-20(30-34(21)25(35)36-6-3)24-29-31-32-33(24)17-18-11-8-7-9-12-18/h7-14,19,21,27H,4-6,15-17H2,1-3H3
InChIKey DEVVJRNSFDOBBQ-UHFFFAOYSA-N
Mol Weight 488.6 g/mol
Molecular Formula C26H32N8O2
Exact Mass 488.264822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H1UEpNrKo85
Name ETHYL-6-[3-(1H-PYRROL-2-YL)-PENTAN-3-YL]-3-(1-BENZYL-1H-TETRAZOL-5-YL)-4,4A,7,7A-TETRAHYDRO-1H-PYRROLO-[3,2-C]-PYRIDAZINE-1-CARBOXYLATE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H32N8O2
InChI InChI=1S/C26H32N8O2/c1-4-26(5-2,22-13-10-14-27-22)23-16-21-19(28-23)15-20(30-34(21)25(35)36-6-3)24-29-31-32-33(24)17-18-11-8-7-9-12-18/h7-14,19,21,27H,4-6,15-17H2,1-3H3
InChIKey DEVVJRNSFDOBBQ-UHFFFAOYSA-N
Literature Reference Author S.M.M.LOPES,A.LEMOS,T.M.V.D.P.EMELO
Literature Reference Citation EUR.J.ORG.CHEM.,2014,7039(2014)
Literature Reference DOI 10.1002/ejoc.201402944
Molecular Weight 488.592 g/mol
Solvent CDCl3
Source File Reference UWLU85448