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Pentobarbitone ME
SpectraBase Compound ID ApxzMrURQdP
InChI InChI=1S/C12H20N2O3/c1-5-7-8(3)12(6-2)9(15)13-11(17)14(4)10(12)16/h8H,5-7H2,1-4H3,(H,13,15,17)
InChIKey OIIGBIYLGSWNKY-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C12H20N2O3
Exact Mass 240.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6ZB9nI4lhBE
Name 5-Ethyl-1-methyl-5-(1-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione
CAS Registry Number 57562-99-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20N2O3
InChI InChI=1S/C12H20N2O3/c1-5-7-8(3)12(6-2)9(15)13-11(17)14(4)10(12)16/h8H,5-7H2,1-4H3,(H,13,15,17)
InChIKey OIIGBIYLGSWNKY-UHFFFAOYSA-N
Molecular Weight 240.303 g/mol
SMILES N1C(N(C(C(C1=O)(CC)C(C)CCC)=O)C)=O
SPLASH splash10-0159-3900000000-4a43c23454cdaef65fb9
Source of Spectrum NP-6-4937-0
Synonyms 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-ethyl-1-methyl-5-(1-methylbutyl)- 5-Ethyl-1-methyl-5-(1-methylbutyl)barbituric acid Barbituric acid, 5-ethyl-1-methyl-5-(1-methylbutyl)- N-Methylpentobarbital 5-Ethyl-1-methyl-5-(1-methylbutyl)hexahydropyrimidine-2,4,6-trione
Wiley ID 1105767