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1-[1-METHYL-4-(METHYLPHENYL)-4,5-DIHYDRO-1H-IMIDAZO]-3-(ETHOXYCARBONYLMETHYL)-UREA
SpectraBase Compound ID 6aRWzsAGtrE
InChI InChI=1S/2C16H22N4O3/c2*1-4-23-14(21)9-17-16(22)19-15-18-13(10-20(15)3)12-7-5-11(2)6-8-12/h2*5-8,13H,4,9-10H2,1-3H3,(H2,17,18,19,22)
InChIKey QULNKKQOADQVMH-UHFFFAOYSA-N
Mol Weight 636.75 g/mol
Molecular Formula C32H44N8O6
Exact Mass 636.338381 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7aLbpiCAhWM
Name 1-[1-METHYL-4-(METHYLPHENYL)-4,5-DIHYDRO-1H-IMIDAZO]-3-(ETHOXYCARBONYLMETHYL)-UREA
Compound Number 3G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C32H44N8O6
InChI InChI=1S/2C16H22N4O3/c2*1-4-23-14(21)9-17-16(22)19-15-18-13(10-20(15)3)12-7-5-11(2)6-8-12/h2*5-8,13H,4,9-10H2,1-3H3,(H2,17,18,19,22)
InChIKey QULNKKQOADQVMH-UHFFFAOYSA-N
Literature Reference Author E.SZACON,M.RZADKOWSKA,A.A.KACZOR,E.KEDZIERSKA,S.FIDECKA,D.MA TOSIUK
Literature Reference Citation MOLECULES,20,3821(2015)
Literature Reference DOI 10.3390/molecules20033821
Molecular Weight 636.751 g/mol
Solvent DMSO-D6
Source File Reference UWPA3007