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1-Methyl-4-thio-5,5-diethylbarbituric acid

View entire compound with spectra: 1 MS (GC)

1-Methyl-4-thio-5,5-diethylbarbituric acid
SpectraBase Compound ID 2b3WIsRKdEE
InChI InChI=1S/C9H14N2O2S/c1-4-9(5-2)6(14)10-8(13)11(3)7(9)12/h4-5H2,1-3H3,(H,10,13,14)
InChIKey RYQIVDIPYIWRNG-UHFFFAOYSA-N
Mol Weight 214.28 g/mol
Molecular Formula C9H14N2O2S
Exact Mass 214.077599 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNrDvLTg97n
Name 1-Methyl-4-thio-5,5-diethylbarbituric acid
Alternate Name(s) 5,5-Diethyl-3-methyl-6-sulfanylidene-1,3-diazinane-2,4-dione 5,5-Diethyl-3-methyl-6-thioxo-5,6-dihydrouracil 5,5-Diethyl-3-methyl-6-thioxo-hexahydropyrimidine-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14N2O2S
InChI InChI=1S/C9H14N2O2S/c1-4-9(5-2)6(14)10-8(13)11(3)7(9)12/h4-5H2,1-3H3,(H,10,13,14)
InChIKey RYQIVDIPYIWRNG-UHFFFAOYSA-N
Molecular Weight 214.283 g/mol
SMILES N1C(C(C(N(C1=O)C)=O)(CC)CC)=S
SPLASH splash10-000i-4910000000-4076b5d0a44385885a15
Source of Spectrum HC-12-445-0
Wiley ID 1213105