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1-(ADENIN-9-YL)-2-HYDROXY-4-OXAPENT-5-YL-21-CROWN-7
SpectraBase Compound ID 7jvKGQM4rBb
InChI InChI=1S/C23H39N5O9/c24-22-21-23(26-17-25-22)28(18-27-21)13-19(29)14-36-16-20-15-35-10-9-33-6-5-31-2-1-30-3-4-32-7-8-34-11-12-37-20/h17-20,29H,1-16H2,(H2,24,25,26)
InChIKey UFPUZMKPUXZBPB-UHFFFAOYSA-N
Mol Weight 529.6 g/mol
Molecular Formula C23H39N5O9
Exact Mass 529.274778 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8SWp4bpnGpR
Name 1-(ADENIN-9-YL)-2-HYDROXY-4-OXAPENT-5-YL-21-CROWN-7
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H39N5O9
InChI InChI=1S/C23H39N5O9/c24-22-21-23(26-17-25-22)28(18-27-21)13-19(29)14-36-16-20-15-35-10-9-33-6-5-31-2-1-30-3-4-32-7-8-34-11-12-37-20/h17-20,29H,1-16H2,(H2,24,25,26)
InChIKey UFPUZMKPUXZBPB-UHFFFAOYSA-N
Instrument Name Varian XL-200
Literature Reference P.HOLY, M.BELOHRADSKY, I.STIBOR, J.KOUDELKA, D.SAMAN, J.HODACOVA, A.HOLY,J.ZAVADA (1987) Coll.Czech.Chem.Comm.: v.52, N12, 2971-2982.
NMR Standard DMSO-D6
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D6SO dimethylsulfo