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1,3-benzodioxol-5-ylmethyl 4-[4-(diethylamino)phenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
SpectraBase Compound ID 5Oob1IlsHkf
InChI InChI=1S/C24H27N3O5/c1-4-27(5-2)18-9-7-17(8-10-18)22-21(15(3)25-24(29)26-22)23(28)30-13-16-6-11-19-20(12-16)32-14-31-19/h6-12,22H,4-5,13-14H2,1-3H3,(H2,25,26,29)
InChIKey KGUOQMOGTPCDGA-UHFFFAOYSA-N
Mol Weight 437.5 g/mol
Molecular Formula C24H27N3O5
Exact Mass 437.195071 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GuNA2jlD7zO
Name 5-pyrimidinecarboxylic acid, 4-[4-(diethylamino)phenyl]-1,2,3,4-tetrahydro-6-methyl-2-oxo-, 1,3-benzodioxol-5-ylmethyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 437.195070976 u
Formula C24H27N3O5
InChI InChI=1S/C24H27N3O5/c1-4-27(5-2)18-9-7-17(8-10-18)22-21(15(3)25-24(29)26-22)23(28)30-13-16-6-11-19-20(12-16)32-14-31-19/h6-12,22H,4-5,13-14H2,1-3H3,(H2,25,26,29)
InChIKey KGUOQMOGTPCDGA-UHFFFAOYSA-N
Molecular Weight 437.496 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_188
Solvent DMSO-d6
Source Vendor ID: ZI/7116659; Lab Info: SAS; Lab Number: SAS-0007665
Temperature 29.85 °C