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Aprobarbital
SpectraBase Compound ID 8YFU2G7Z3QB
InChI InChI=1S/C10H14N2O3/c1-4-5-10(6(2)3)7(13)11-9(15)12-8(10)14/h4,6H,1,5H2,2-3H3,(H2,11,12,13,14,15)
InChIKey UORJNBVJVRLXMQ-UHFFFAOYSA-N
Mol Weight 210.23 g/mol
Molecular Formula C10H14N2O3
Exact Mass 210.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DknuNhNqaPo
Name Aprobarbitone
CAS Registry Number 77-02-1
Classification Pharmaceutical drug, hypnotic
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
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 210.100442316 u
Formula C10H14N2O3
InChI InChI=1S/C10H14N2O3/c1-4-5-10(6(2)3)7(13)11-9(15)12-8(10)14/h4,6H,1,5H2,2-3H3,(H2,11,12,13,14,15)
InChIKey UORJNBVJVRLXMQ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 210.233 g/mol
Nominal Mass 210 u
Quality 939
Retention Index 1711
SMILES C1(C(NC(NC1=O)=O)=O)(C(C)C)CC=C
SPLASH splash10-014i-3900000000-048d8e5a18d9ac413e00
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Aprobarbital 5-Propan-2-yl-5-prop-2-enyl-1,3-diazinane-2,4,6-trione
Technique GC/MS
Wiley ID DD2024_025624