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6-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]-1,3-dimethyl-5-phenyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
SpectraBase Compound ID 2JhQ1VGYsPP
InChI InChI=1S/C18H21N3O5/c1-19-13-8-21(18(9-22,10-23)11-24)15(12-6-4-3-5-7-12)14(13)16(25)20(2)17(19)26/h3-8,22-24H,9-11H2,1-2H3
InChIKey BYEDCPAONWEOCV-UHFFFAOYSA-N
Mol Weight 359.38 g/mol
Molecular Formula C18H21N3O5
Exact Mass 359.148121 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7cji41jFkvb
Name 6-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]-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/C18H21N3O5/c1-19-13-8-21(18(9-22,10-23)11-24)15(12-6-4-3-5-7-12)14(13)16(25)20(2)17(19)26/h3-8,22-24H,9-11H2,1-2H3
InChIKey BYEDCPAONWEOCV-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_22707
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: D35718; Labnumber: RRSHE-0088; SBI_ID: SBI-022711
Temperature 306 °C