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N-(4-tert-butylcyclohexyl)-2-(1-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide
SpectraBase Compound ID IcMidYRHwC
InChI InChI=1S/C18H27N5O2/c1-18(2,3)12-5-7-13(8-6-12)21-15(24)10-23-11-19-16-14(17(23)25)9-20-22(16)4/h9,11-13H,5-8,10H2,1-4H3,(H,21,24)
InChIKey HCCOWZDFEXQMND-UHFFFAOYSA-N
Mol Weight 345.45 g/mol
Molecular Formula C18H27N5O2
Exact Mass 345.216475 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1lAqS0XInvy
Name N-(4-tert-butylcyclohexyl)-2-(1-methyl-4-oxo-1,4-dihydro-5H-pyrazolo[3,4-d]pyrimidin-5-yl)acetamide
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/C18H27N5O2/c1-18(2,3)12-5-7-13(8-6-12)21-15(24)10-23-11-19-16-14(17(23)25)9-20-22(16)4/h9,11-13H,5-8,10H2,1-4H3,(H,21,24)
InChIKey HCCOWZDFEXQMND-UHFFFAOYSA-N
NMR Offset 17.9111
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_33956
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: 1998161; SBI_ID: SBI-033960
Temperature 303 °C