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Crotylbarbital
SpectraBase Compound ID 8UXr3CwQbgr
InChI InChI=1S/C10H14N2O3/c1-3-5-6-10(4-2)7(13)11-9(15)12-8(10)14/h3,5H,4,6H2,1-2H3,(H2,11,12,13,14,15)/b5-3+
InChIKey KNMOHCLEINXVBG-HWKANZROSA-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 DlH1wEJhvGa
Name Crotylbarbitone
CAS Registry Number 1952-67-6
Classification Pharmaceutical drug, hypnotic
Comments Spectrum verified by independent measurements in external laboratories
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/c1-3-5-6-10(4-2)7(13)11-9(15)12-8(10)14/h3,5H,4,6H2,1-2H3,(H2,11,12,13,14,15)/b5-3+
InChIKey KNMOHCLEINXVBG-HWKANZROSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 210.233 g/mol
Nominal Mass 210 u
Quality 879
Retention Index 1711
SMILES C1(C(NC(NC1=O)=O)=O)(C\C=C\C)CC
SPLASH splash10-0a59-9810000000-b289903b387d92612ae5
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Crotylbarbital 5-But-2-enyl-5-ethyl-1,3-diazinane-2,4,6-trione
Technique GC/MS
Wiley ID DD2024_000828