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5-[p-(dimethylamino)benzylidene]-2-thiobarbituric acid
SpectraBase Compound ID 2ttCwBBcdL
InChI InChI=1S/C13H13N3O2S/c1-16(2)9-5-3-8(4-6-9)7-10-11(17)14-13(19)15-12(10)18/h3-7H,1-2H3,(H2,14,15,17,18,19)
InChIKey UOUVLKPLCQPNES-UHFFFAOYSA-N
Mol Weight 275.33 g/mol
Molecular Formula C13H13N3O2S
Exact Mass 275.072848 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2plVY97Bk3i
Name 5-[(4-dimethylaminophenyl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Alternate Name(s) 5-[4-(Dimethylamino)benzylidene]-2-thiobarbituric acid 5-[4-(dimethylamino)benzylidene]-2-thioxo-hexahydropyrimidine-4,6-quinone 5-[4-(Dimethylamino)benzylidene]-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione 5-[[4-(dimethylamino)phenyl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione
CAS Registry Number 27430-15-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13N3O2S
InChI InChI=1S/C13H13N3O2S/c1-16(2)9-5-3-8(4-6-9)7-10-11(17)14-13(19)15-12(10)18/h3-7H,1-2H3,(H2,14,15,17,18,19)
InChIKey UOUVLKPLCQPNES-UHFFFAOYSA-N
Molecular Weight 275.326 g/mol
SMILES OC1=NC(N=C(C1=Cc1ccc(cc1)N(C)C)O)=S
SPLASH splash10-00di-0910000000-0c55a695bebf15779145
Source of Spectrum HC-20-799-0
Wiley ID 1278954