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2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(1-cyclohepten-1-yl)-5-ethyl-1,3-dimethyl-
SpectraBase Compound ID 5XuknSFSMfI
InChI InChI=1S/C15H22N2O3/c1-4-15(11-9-7-5-6-8-10-11)12(18)16(2)14(20)17(3)13(15)19/h9H,4-8,10H2,1-3H3
InChIKey IOWZYALHIKMITA-UHFFFAOYSA-N
Mol Weight 278.35 g/mol
Molecular Formula C15H22N2O3
Exact Mass 278.163043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fSt7gEHRY
Name Heptabarbital 2ME
Classification Hypnotic
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Exact Mass 278.163042573 u
Formula C15H22N2O3
InChI InChI=1S/C15H22N2O3/c1-4-15(11-9-7-5-6-8-10-11)12(18)16(2)14(20)17(3)13(15)19/h9H,4-8,10H2,1-3H3
InChIKey IOWZYALHIKMITA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 278.352 g/mol
SMILES C(C1(C(=O)N(C(N(C1=O)C)=O)C)C=1CCCCCC1)C
SPLASH splash10-00kb-6690000000-62ebc1316469f345e51b
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Technique GC/MS
Wiley ID MMPW6e_806