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2-{[2-(acetylamino)-6-chloro-9H-purin-9-yl]methoxy}-3-(acetyloxy)propyl acetate
SpectraBase Compound ID JDDDu96ROCW
InChI InChI=1S/C15H18ClN5O6/c1-8(22)18-15-19-13(16)12-14(20-15)21(6-17-12)7-27-11(4-25-9(2)23)5-26-10(3)24/h6,11H,4-5,7H2,1-3H3,(H,18,19,20,22)
InChIKey QYFOWPIZFVVELP-UHFFFAOYSA-N
Mol Weight 399.79 g/mol
Molecular Formula C15H18ClN5O6
Exact Mass 399.094561 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID hbpjXQboi4
Name 2-{[2-(acetylamino)-6-chloro-9H-purin-9-yl]methoxy}-3-(acetyloxy)propyl acetate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C15H18ClN5O6/c1-8(22)18-15-19-13(16)12-14(20-15)21(6-17-12)7-27-11(4-25-9(2)23)5-26-10(3)24/h6,11H,4-5,7H2,1-3H3,(H,18,19,20,22)
InChIKey QYFOWPIZFVVELP-UHFFFAOYSA-N
NMR Offset 15.0036
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7000_2849
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: ZI/6076581; Labnumber: SS-0000014; IOH_ID: IOH-002850
Temperature 297 °C