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1,3-Dimethylbarbituric acid
SpectraBase Compound ID QXDFnm3fRi
InChI InChI=1S/C6H8N2O3/c1-7-4(9)3-5(10)8(2)6(7)11/h3H2,1-2H3
InChIKey VVSASNKOFCZVES-UHFFFAOYSA-N
Mol Weight 156.14 g/mol
Molecular Formula C6H8N2O3
Exact Mass 156.053492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DoCXWdZgZ3w
Name 1,3-Dimethylbarbituric acid
CAS Registry Number 769-42-6
Classification Pharmaceutical drug precursor
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
DEA Citation 21 CFR §1308.13 (c) (3)
DEA Controlled Substance Form Any compound, mixture or preparation
DEA Controlled Substance Name Barbituric acid derivatives
DEA Controlled Substance Type Salts, isomers, derivatives and salts of isomers and derivatives
DEA Controlled Substances Code Number 2100
DEA Schedule Schedule III
DEA Section Depressants. Unless specifically excepted or unless listed in another schedule, any material, compound, mixture, or preparation which contains any quantity of the following substances having a depressant effect on the central nervous system
Exact Mass 156.053492123 u
Formula C6H8N2O3
InChI InChI=1S/C6H8N2O3/c1-7-4(9)3-5(10)8(2)6(7)11/h3H2,1-2H3
InChIKey VVSASNKOFCZVES-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 156.141 g/mol
Nominal Mass 156 u
Quality 985
Retention Index 1247
SMILES C1(N(C(CC(N1C)=O)=O)C)=O
SPLASH splash10-0006-9100000000-8aa8c0b338180d4797ea
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1,3-dimethyl-1,3-diazinane-2,4,6-trione
Technique GC/MS
Wiley ID DD2024_005685