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6-butyl-5-(4-tert-butylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione

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6-butyl-5-(4-tert-butylphenyl)-1,3-dimethyl-1H-pyrrolo[3,4-d]pyrimidine-2,4(3H,6H)-dione
SpectraBase Compound ID 6R3xoTyD3QN
InChI InChI=1S/C22H29N3O2/c1-7-8-13-25-14-17-18(20(26)24(6)21(27)23(17)5)19(25)15-9-11-16(12-10-15)22(2,3)4/h9-12,14H,7-8,13H2,1-6H3
InChIKey SKDWOHNOWBQVFJ-UHFFFAOYSA-N
Mol Weight 367.49 g/mol
Molecular Formula C22H29N3O2
Exact Mass 367.225977 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6XrAvg9wkfO
Name 6-butyl-5-(4-tert-butylphenyl)-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/C22H29N3O2/c1-7-8-13-25-14-17-18(20(26)24(6)21(27)23(17)5)19(25)15-9-11-16(12-10-15)22(2,3)4/h9-12,14H,7-8,13H2,1-6H3
InChIKey SKDWOHNOWBQVFJ-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_27902
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: D79559; Labnumber: SC_0129-1133; SBI_ID: SBI-027906
Temperature 306 °C