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1-{4-[2-(cyclopentyloxy)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl}ethanone
SpectraBase Compound ID F9UYKbolR1e
InChI InChI=1S/C18H22N2O2S/c1-11-16(12(2)21)17(20-18(23)19-11)14-9-5-6-10-15(14)22-13-7-3-4-8-13/h5-6,9-10,13,17H,3-4,7-8H2,1-2H3,(H2,19,20,23)
InChIKey IMHGJCRMFBJJBY-UHFFFAOYSA-N
Mol Weight 330.45 g/mol
Molecular Formula C18H22N2O2S
Exact Mass 330.140199 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AzFAU6fytl6
Name 1-{4-[2-(cyclopentyloxy)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinyl}ethanone
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/C18H22N2O2S/c1-11-16(12(2)21)17(20-18(23)19-11)14-9-5-6-10-15(14)22-13-7-3-4-8-13/h5-6,9-10,13,17H,3-4,7-8H2,1-2H3,(H2,19,20,23)
InChIKey IMHGJCRMFBJJBY-UHFFFAOYSA-N
NMR Offset 17.9107
NMR Spectrometer Frequency 500.077
Observed nucleus 1H
Origin 1H_SBI_36227_31582
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: 1843051; SBI_ID: SBI-031586
Temperature 303 °C