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(1R,3R,4R,7R)-7-BENZYLOXY-1-(HYDROXYMETHYL)-3-(THYMIN-1-YL)-2-OXA-5-AZABICYCLO-[2.2.1]-HEPTANE
SpectraBase Compound ID 1m0pYIoPO3K
InChI InChI=1S/C18H21N3O4/c1-12-7-21(11-20-16(12)23)17-14-15(18(10-22,25-17)9-19-14)24-8-13-5-3-2-4-6-13/h2-7,11,14-15,17,19,22H,8-10H2,1H3/t14-,15-,17-,18-/m1/s1
InChIKey LGBLNZVDQIUAOQ-JOCBIADPSA-N
Mol Weight 343.38 g/mol
Molecular Formula C18H21N3O4
Exact Mass 343.153206 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GCbrtPrR15L
Name (1R,3R,4R,7R)-7-BENZYLOXY-1-(HYDROXYMETHYL)-3-(THYMIN-1-YL)-2-OXA-5-AZABICYCLO-[2.2.1]-HEPTANE
Compound Number 2 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H21N3O4
InChI InChI=1S/C18H21N3O4/c1-12-7-21(11-20-16(12)23)17-14-15(18(10-22,25-17)9-19-14)24-8-13-5-3-2-4-6-13/h2-7,11,14-15,17,19,22H,8-10H2,1H3/t14-,15-,17-,18-/m1/s1
InChIKey LGBLNZVDQIUAOQ-JOCBIADPSA-N
Literature Reference Author B.R.BABU,RAUNAK,N.E.POOPEIKO,M.JUHL,A.D.BOND,V.S.PARMAR,J.WE NGEL
Literature Reference Citation EUR.J.ORG.CHEM.,2297(2005)
Literature Reference DOI 10.1002/ejoc.200500023
Molecular Weight 343.382 g/mol
Sample ID 39317
Solvent DMSO-D6