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cyclooctyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

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cyclooctyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID JX97I7VjKWG
InChI InChI=1S/C21H26N2O5/c1-13-18(20(24)28-15-7-5-3-2-4-6-8-15)19(23-21(25)22-13)14-9-10-16-17(11-14)27-12-26-16/h9-11,15,19H,2-8,12H2,1H3,(H2,22,23,25)
InChIKey XVUAKYNXGLGXST-UHFFFAOYSA-N
Mol Weight 386.45 g/mol
Molecular Formula C21H26N2O5
Exact Mass 386.184172 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9qekZaALJM1
Name cyclooctyl 4-(1,3-benzodioxol-5-yl)-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
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/C21H26N2O5/c1-13-18(20(24)28-15-7-5-3-2-4-6-8-15)19(23-21(25)22-13)14-9-10-16-17(11-14)27-12-26-16/h9-11,15,19H,2-8,12H2,1H3,(H2,22,23,25)
InChIKey XVUAKYNXGLGXST-UHFFFAOYSA-N
NMR Offset 17.1563
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_17107
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: UZI/7107604; Labnumber: SAS0001104; UZI_ID: UZI-017113
Temperature 308 °C