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1H-purine-2,6-dione, 8-[[2-(4-chlorophenoxy)ethyl]amino]-3,7-dihydro-1,3,7-trimethyl-
SpectraBase Compound ID 5zOrQYlrfiY
InChI InChI=1S/C16H18ClN5O3/c1-20-12-13(21(2)16(24)22(3)14(12)23)19-15(20)18-8-9-25-11-6-4-10(17)5-7-11/h4-7H,8-9H2,1-3H3,(H,18,19)
InChIKey OATCSADIHHHJKQ-UHFFFAOYSA-N
Mol Weight 363.81 g/mol
Molecular Formula C16H18ClN5O3
Exact Mass 363.109817 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GEuCSIXOwPQ
Name 1H-purine-2,6-dione, 8-[[2-(4-chlorophenoxy)ethyl]amino]-3,7-dihydro-1,3,7-trimethyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 363.109817157 u
Formula C16H18ClN5O3
InChI InChI=1S/C16H18ClN5O3/c1-20-12-13(21(2)16(24)22(3)14(12)23)19-15(20)18-8-9-25-11-6-4-10(17)5-7-11/h4-7H,8-9H2,1-3H3,(H,18,19)
InChIKey OATCSADIHHHJKQ-UHFFFAOYSA-N
Molecular Weight 363.805 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_4882
Solvent DMSO-d6
Source Vendor ID: NMR/10210081; Lab Info: LP; Lab Number: 25-833