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Ethyl 3-methyl-1,2,3,4-tetrahydropyrimidin-2-thione-5-carboxylate
SpectraBase Compound ID 3aTn30rIfpf
InChI InChI=1S/C8H12N2O2S/c1-3-12-7(11)6-4-9-8(13)10(2)5-6/h4H,3,5H2,1-2H3,(H,9,13)
InChIKey KLFUDVKMOJGOST-UHFFFAOYSA-N
Mol Weight 200.26 g/mol
Molecular Formula C8H12N2O2S
Exact Mass 200.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C0kIvxn2CM5
Name Ethyl 3-methyl-1,2,3,4-tetrahydropyrimidin-2-thione-5-carboxylate
Alternate Name(s) Ethyl 3-methyl-2-thioxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12N2O2S
InChI InChI=1S/C8H12N2O2S/c1-3-12-7(11)6-4-9-8(13)10(2)5-6/h4H,3,5H2,1-2H3,(H,9,13)
InChIKey KLFUDVKMOJGOST-UHFFFAOYSA-N
Molecular Weight 200.256 g/mol
SMILES N1C(N(CC(=C1)C(=O)OCC)C)=S
SPLASH splash10-0uk9-2970000000-5365ce659577b07ba4fc
Source of Spectrum SO-0-700-10
Wiley ID 877647