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2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-cyclohexen-1-yl)-1,3,5-trimethyl-
SpectraBase Compound ID 7dUgLkP3i3D
InChI InChI=1S/C13H18N2O3/c1-13(9-7-5-4-6-8-9)10(16)14(2)12(18)15(3)11(13)17/h7H,4-6,8H2,1-3H3
InChIKey PCTJGZPAPPNSKM-UHFFFAOYSA-N
Mol Weight 250.3 g/mol
Molecular Formula C13H18N2O3
Exact Mass 250.131742 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JEX2Aq94vVg
Name Hexobarbitone ME
CAS Registry Number 726-79-4
Classification Pharmaceutical drug, hypnotic
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 250.131742445 u
Formula C13H18N2O3
InChI InChI=1S/C13H18N2O3/c1-13(9-7-5-4-6-8-9)10(16)14(2)12(18)15(3)11(13)17/h7H,4-6,8H2,1-3H3
InChIKey PCTJGZPAPPNSKM-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 250.298 g/mol
Nominal Mass 250 u
Quality 995
Retention Index 1965
SMILES C1(C(N(C(N(C1=O)C)=O)C)=O)(C1=CCCCC1)C
SPLASH splash10-000i-9780000000-4bbb89687946ff298be0
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 5-(cyclohex-1-en-1-yl)-1,3,5-trimethyl-1,3-diazinane-2,4,6-trione
Technique GC/MS
Wiley ID DD2024_033612