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tert-butyl 4-(3-bromophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate

View entire compound with spectra: 1 NMR

tert-butyl 4-(3-bromophenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID GHRApkNXA4n
InChI InChI=1S/C16H19BrN2O2S/c1-9-12(14(20)21-16(2,3)4)13(19-15(22)18-9)10-6-5-7-11(17)8-10/h5-8,13H,1-4H3,(H2,18,19,22)
InChIKey VSDYIJDVCVKPPX-UHFFFAOYSA-N
Mol Weight 383.3 g/mol
Molecular Formula C16H19BrN2O2S
Exact Mass 382.035062 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KwkdacOneO9
Name tert-butyl 4-(3-bromophenyl)-6-methyl-2-thioxo-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/C16H19BrN2O2S/c1-9-12(14(20)21-16(2,3)4)13(19-15(22)18-9)10-6-5-7-11(17)8-10/h5-8,13H,1-4H3,(H2,18,19,22)
InChIKey VSDYIJDVCVKPPX-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_20063
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: D16915; Labnumber: EX00135922; SBI_ID: SBI-020067
Temperature 306 °C