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N-[3-(ADENIN-9-YL)-2-HYDROXYPROPYL]-1-AZA-18-CROWN-6
SpectraBase Compound ID L3ae06eBdHi
InChI InChI=1S/C20H34N6O6/c21-19-18-20(23-15-22-19)26(16-24-18)14-17(27)13-25-1-3-28-5-7-30-9-11-32-12-10-31-8-6-29-4-2-25/h15-17,27H,1-14H2,(H2,21,22,23)
InChIKey RHVXLHHIDPAVSX-UHFFFAOYSA-N
Mol Weight 454.5 g/mol
Molecular Formula C20H34N6O6
Exact Mass 454.253983 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DEAeldckWEi
Name N-[3-(ADENIN-9-YL)-2-HYDROXYPROPYL]-1-AZA-18-CROWN-6
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C20H34N6O6
InChI InChI=1S/C20H34N6O6/c21-19-18-20(23-15-22-19)26(16-24-18)14-17(27)13-25-1-3-28-5-7-30-9-11-32-12-10-31-8-6-29-4-2-25/h15-17,27H,1-14H2,(H2,21,22,23)
InChIKey RHVXLHHIDPAVSX-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