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6-(3-chloro-4-methoxyphenyl)-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
SpectraBase Compound ID KUbaQh7hah6
InChI InChI=1S/C21H18ClN3O3/c1-23-16-12-25(14-9-10-17(28-3)15(22)11-14)19(13-7-5-4-6-8-13)18(16)20(26)24(2)21(23)27/h4-12H,1-3H3
InChIKey STLASIXCLMEUQK-UHFFFAOYSA-N
Mol Weight 395.85 g/mol
Molecular Formula C21H18ClN3O3
Exact Mass 395.103669 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6OUrdSTsX3i
Name 6-(3-chloro-4-methoxyphenyl)-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
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/C21H18ClN3O3/c1-23-16-12-25(14-9-10-17(28-3)15(22)11-14)19(13-7-5-4-6-8-13)18(16)20(26)24(2)21(23)27/h4-12H,1-3H3
InChIKey STLASIXCLMEUQK-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27940
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: D79614; Labnumber: SC_0129-1279; SBI_ID: SBI-027944
Temperature 306 °C