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3-(2-dimethylaminoethyl)-1-[3-[(2-dimethylaminoethylcarbamoylamino)methyl]benzyl]urea
SpectraBase Compound ID IODBmZDWoF8
InChI InChI=1S/C18H32N6O2/c1-23(2)10-8-19-17(25)21-13-15-6-5-7-16(12-15)14-22-18(26)20-9-11-24(3)4/h5-7,12H,8-11,13-14H2,1-4H3,(H2,19,21,25)(H2,20,22,26)
InChIKey PXLFVWQJJAMIIG-UHFFFAOYSA-N
Mol Weight 364.5 g/mol
Molecular Formula C18H32N6O2
Exact Mass 364.258674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CrKPlM8IkbD
Name 3-(2-dimethylaminoethyl)-1-[3-[(2-dimethylaminoethylcarbamoylamino)methyl]benzyl]urea
Compound Number 38
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H32N6O2
InChI InChI=1S/C18H32N6O2/c1-23(2)10-8-19-17(25)21-13-15-6-5-7-16(12-15)14-22-18(26)20-9-11-24(3)4/h5-7,12H,8-11,13-14H2,1-4H3,(H2,19,21,25)(H2,20,22,26)
InChIKey PXLFVWQJJAMIIG-UHFFFAOYSA-N
Literature Reference Author H.H.ZEPIK,S.A.BENNER
Literature Reference Citation J.ORG.CHEM.,64,8080(1999)
Literature Reference DOI 10.1021/jo982418+
Molecular Weight 364.491 g/mol
Sample ID 40423
Solvent DMSO-D6