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1-[1-METHYL-4-(METHYLPHENYL)-4,5-DIHYDRO-1H-IMIDAZO]-3-AMINOCARBONYLMETHYLUREA
SpectraBase Compound ID Gve5xTMaBPk
InChI InChI=1S/2C14H19N5O2/c2*1-9-3-5-10(6-4-9)11-8-19(2)13(17-11)18-14(21)16-7-12(15)20/h2*3-6,11H,7-8H2,1-2H3,(H2,15,20)(H2,16,17,18,21)
InChIKey QNISSDBYQLQZTD-UHFFFAOYSA-N
Mol Weight 578.68 g/mol
Molecular Formula C28H38N10O4
Exact Mass 578.30775 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KeJhXWtlXiq
Name 1-[1-METHYL-4-(METHYLPHENYL)-4,5-DIHYDRO-1H-IMIDAZO]-3-AMINOCARBONYLMETHYLUREA
Compound Number 4G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H38N10O4
InChI InChI=1S/2C14H19N5O2/c2*1-9-3-5-10(6-4-9)11-8-19(2)13(17-11)18-14(21)16-7-12(15)20/h2*3-6,11H,7-8H2,1-2H3,(H2,15,20)(H2,16,17,18,21)
InChIKey QNISSDBYQLQZTD-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 578.674 g/mol
Solvent DMSO-D6
Source File Reference UWPA3010