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N-[3-(ADENIN-9-YL)-2-HYDROXYPROPYL]-1-AZA-15-CROWN-5

View entire compound with spectra: 1 NMR

N-[3-(ADENIN-9-YL)-2-HYDROXYPROPYL]-1-AZA-15-CROWN-5
SpectraBase Compound ID IupZBGIHrYA
InChI InChI=1S/C18H30N6O5/c19-17-16-18(21-13-20-17)24(14-22-16)12-15(25)11-23-1-3-26-5-7-28-9-10-29-8-6-27-4-2-23/h13-15,25H,1-12H2,(H2,19,20,21)
InChIKey JPLOSXRJRKESQC-UHFFFAOYSA-N
Mol Weight 410.48 g/mol
Molecular Formula C18H30N6O5
Exact Mass 410.227768 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2bpKlly9NIb
Name N-[3-(ADENIN-9-YL)-2-HYDROXYPROPYL]-1-AZA-15-CROWN-5
Comments CK
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C18H30N6O5
InChI InChI=1S/C18H30N6O5/c19-17-16-18(21-13-20-17)24(14-22-16)12-15(25)11-23-1-3-26-5-7-28-9-10-29-8-6-27-4-2-23/h13-15,25H,1-12H2,(H2,19,20,21)
InChIKey JPLOSXRJRKESQC-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