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5-(4-tert-butylphenyl)-6-(4-methoxyphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
SpectraBase Compound ID Kv4NvEeYpSJ
InChI InChI=1S/C25H27N3O3/c1-25(2,3)17-9-7-16(8-10-17)22-21-20(26(4)24(30)27(5)23(21)29)15-28(22)18-11-13-19(31-6)14-12-18/h7-15H,1-6H3
InChIKey WKBGRHXBOXNLLI-UHFFFAOYSA-N
Mol Weight 417.51 g/mol
Molecular Formula C25H27N3O3
Exact Mass 417.205242 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FBg1h87P60S
Name 5-(4-tert-butylphenyl)-6-(4-methoxyphenyl)-1,3-dimethyl-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/C25H27N3O3/c1-25(2,3)17-9-7-16(8-10-17)22-21-20(26(4)24(30)27(5)23(21)29)15-28(22)18-11-13-19(31-6)14-12-18/h7-15H,1-6H3
InChIKey WKBGRHXBOXNLLI-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27908
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: D79565; Labnumber: SC_0129-1146; SBI_ID: SBI-027912
Temperature 306 °C