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1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione, 5-(3-bromophenyl)-6-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]-1,3-dimethyl-
SpectraBase Compound ID 1rRupu6F0Fo
InChI InChI=1S/C18H20BrN3O5/c1-20-13-7-22(18(8-23,9-24)10-25)15(11-4-3-5-12(19)6-11)14(13)16(26)21(2)17(20)27/h3-7,23-25H,8-10H2,1-2H3
InChIKey XWCFBCHIIIHCKU-UHFFFAOYSA-N
Mol Weight 438.28 g/mol
Molecular Formula C18H20BrN3O5
Exact Mass 437.058634 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7jIg0k20Jrt
Name 1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione, 5-(3-bromophenyl)-6-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]-1,3-dimethyl-
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/C18H20BrN3O5/c1-20-13-7-22(18(8-23,9-24)10-25)15(11-4-3-5-12(19)6-11)14(13)16(26)21(2)17(20)27/h3-7,23-25H,8-10H2,1-2H3
InChIKey XWCFBCHIIIHCKU-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_5036
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: F23596; Labnumber: RRTK-1442