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1-(4,4-dimethyl-2-pentynoyl)-1,3-di-1-naphthylurea
SpectraBase Compound ID 6299J9KDN4N
InChI InChI=1S/C28H24N2O2/c1-28(2,3)19-18-26(31)30(25-17-9-13-21-11-5-7-15-23(21)25)27(32)29-24-16-8-12-20-10-4-6-14-22(20)24/h4-17H,1-3H3,(H,29,32)
InChIKey ULUFKQYPIFZWFP-UHFFFAOYSA-N
Mol Weight 420.51 g/mol
Molecular Formula C28H24N2O2
Exact Mass 420.183778 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BDzldvP2z5k
Name 1-(4,4-DIMETHYL-2-PENTYNOYL)-1,3-DI-1-NAPHTHYLUREA
Source of Sample G. A. Molander and H. C. Brown, Purdue University, West Lafayette, Indiana
Comments Tentative assignment; Some carbon atoms are unassigned
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H24N2O2
InChI InChI=1S/C28H24N2O2/c1-28(2,3)19-18-26(31)30(25-17-9-13-21-11-5-7-15-23(21)25)27(32)29-24-16-8-12-20-10-4-6-14-22(20)24/h4-17H,1-3H3,(H,29,32)
InChIKey ULUFKQYPIFZWFP-UHFFFAOYSA-N
Melting Point 123-124C
Molecular Weight 420.52
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms UREA, 1-/4,4-DIMETHYL-2-PENTYNOYL/- 1,3-DI-1-NAPHTHYL-,