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Brallobarbital (ME)
SpectraBase Compound ID Djp7g4n7ncW
InChI InChI=1S/C11H13BrN2O3/c1-4-5-11(6-7(2)12)8(15)13-10(17)14(3)9(11)16/h4H,1-2,5-6H2,3H3,(H,13,15,17)
InChIKey FSOXWWXUZIWBJF-UHFFFAOYSA-N
Mol Weight 301.14 g/mol
Molecular Formula C11H13BrN2O3
Exact Mass 300.010955 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6MATBZ9XvK
Name Brallobarbital (ME)
Classification Hypnotic
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Exact Mass 300.010955284 u
Formula C11H13BrN2O3
InChI InChI=1S/C11H13BrN2O3/c1-4-5-11(6-7(2)12)8(15)13-10(17)14(3)9(11)16/h4H,1-2,5-6H2,3H3,(H,13,15,17)
InChIKey FSOXWWXUZIWBJF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 301.140 g/mol
SMILES C=CCC1(C(=O)NC(N(C1=O)C)=O)CC(Br)=C
SPLASH splash10-0fmi-9620000000-fe00dc2df6b1fbcf23fd
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
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_3996