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N-(2-chloroethyl)-N'-(9H-purin-6-yl)urea

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N-(2-chloroethyl)-N'-(9H-purin-6-yl)urea
SpectraBase Compound ID 2d5Yfaoj9j1
InChI InChI=1S/C8H9ClN6O/c9-1-2-10-8(16)15-7-5-6(12-3-11-5)13-4-14-7/h3-4H,1-2H2,(H3,10,11,12,13,14,15,16)
InChIKey LKNCXNRZQGJCKU-UHFFFAOYSA-N
Mol Weight 240.65 g/mol
Molecular Formula C8H9ClN6O
Exact Mass 240.052637 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6zH07XvPo8o
Name N-(2-chloroethyl)-N'-(9H-purin-6-yl)urea
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/C8H9ClN6O/c9-1-2-10-8(16)15-7-5-6(12-3-11-5)13-4-14-7/h3-4H,1-2H2,(H3,10,11,12,13,14,15,16)
InChIKey LKNCXNRZQGJCKU-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI-VK_18310_16690
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: 987/00004236; Labnumber: 987/00004236218851; VK_ID: VK-016695
Temperature 308 °C