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6-BENZYL-5-ISOPROPYL-1-(PROP-2-YNYLOXYMETHYL)-URACIL
SpectraBase Compound ID 1soRkF1zLB6
InChI InChI=1S/C18H20N2O3/c1-4-10-23-12-20-15(11-14-8-6-5-7-9-14)16(13(2)3)17(21)19-18(20)22/h1,5-9,13H,10-12H2,2-3H3,(H,19,21,22)
InChIKey DVMQQOFSSHKVQE-UHFFFAOYSA-N
Mol Weight 312.37 g/mol
Molecular Formula C18H20N2O3
Exact Mass 312.147393 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1GOTTVnQCAA
Name 6-BENZYL-5-ISOPROPYL-1-(PROP-2-YNYLOXYMETHYL)-URACIL
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20N2O3
InChI InChI=1S/C18H20N2O3/c1-4-10-23-12-20-15(11-14-8-6-5-7-9-14)16(13(2)3)17(21)19-18(20)22/h1,5-9,13H,10-12H2,2-3H3,(H,19,21,22)
InChIKey DVMQQOFSSHKVQE-UHFFFAOYSA-N
Literature Reference Author N.R.EL-BROLLOSY,P.T.JORGENSEN,B.DAHAN,A.M.BOEL,E.B.PEDERSEN, C.NIELSEN
Literature Reference Citation J.MED.CHEM.,45,5721(2002)
Literature Reference DOI 10.1021/jm020949r
Molecular Weight 312.368 g/mol
Sample ID 65692
Solvent CDCl3