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Mephobarbital
SpectraBase Compound ID tfdB6YXaAA
InChI InChI=1S/C13H14N2O3/c1-3-13(9-7-5-4-6-8-9)10(16)14-12(18)15(2)11(13)17/h4-8H,3H2,1-2H3,(H,14,16,18)
InChIKey ALARQZQTBTVLJV-UHFFFAOYSA-N
Mol Weight 246.27 g/mol
Molecular Formula C13H14N2O3
Exact Mass 246.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JPZEkIuPpYH
Name Methylphenobarbital @
CAS Registry Number 115-38-8
Classification Hypnotic
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Exact Mass 246.100442316 u
Formula C13H14N2O3
InChI InChI=1S/C13H14N2O3/c1-3-13(9-7-5-4-6-8-9)10(16)14-12(18)15(2)11(13)17/h4-8H,3H2,1-2H3,(H,14,16,18)
InChIKey ALARQZQTBTVLJV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 246.266 g/mol
SMILES c1(ccccc1)C1(C(N(C(NC1=O)=O)C)=O)CC
SPLASH splash10-014i-5950000000-d1a4149dc3b08bc2bb5b
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.
Sample Preparation Procedure Detected: P G U+UHYAC
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Cyclobarbital-M (di-HO-) -2H2O ME Phenobarbital ME
Technique GC/MS
Wiley ID MMPW6e_1120