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3,3-dimethyl-1-{[4-hydroxy-6-methyl-5-(2-methylallyl)-2-pyrimidinyl]thio}-2-butanone, dimethylcarbamate (ester)
SpectraBase Compound ID 6VZppFNNj5V
InChI InChI=1S/C18H27N3O3S/c1-11(2)9-13-12(3)19-16(25-10-14(22)18(4,5)6)20-15(13)24-17(23)21(7)8/h1,9-10H2,2-8H3
InChIKey DLPAMMSTUNNPAP-UHFFFAOYSA-N
Mol Weight 365.49 g/mol
Molecular Formula C18H27N3O3S
Exact Mass 365.177313 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CezY7s2dg9C
Name 3,3-DIMETHYL-1-{[4-HYDROXY-6-METHYL-5-(2-METHYLALLYL)-2-PYRIMIDINYL]THIO}-2-BUTANONE, DIMETHYLCARBAMATE (ESTER)
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H27N3O3S
InChI InChI=1S/C18H27N3O3S/c1-11(2)9-13-12(3)19-16(25-10-14(22)18(4,5)6)20-15(13)24-17(23)21(7)8/h1,9-10H2,2-8H3
InChIKey DLPAMMSTUNNPAP-UHFFFAOYSA-N
Melting Point 92-95C
Molecular Weight 365.50
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 2-BUTANONE, 3,3-DIMETHYL- 1-//4-HYDROXY-6-METHYL-5-/2-METHYLALLYL/-2-PYRIMIDINYL/THIO/-, DIMETHYLCARBAMATE (ESTER)