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Butalbital
SpectraBase Compound ID JDWs6gQPm9K
InChI InChI=1S/C11H16N2O3/c1-4-5-11(6-7(2)3)8(14)12-10(16)13-9(11)15/h4,7H,1,5-6H2,2-3H3,(H2,12,13,14,15,16)
InChIKey UZVHFVZFNXBMQJ-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C11H16N2O3
Exact Mass 224.116092 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 89FCuzco9Fv
Name 5-Allyl-5-isobutyl-barbituric acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16N2O3
InChI InChI=1S/C11H16N2O3/c1-4-5-11(6-7(2)3)8(14)12-10(16)13-9(11)15/h4,7H,1,5-6H2,2-3H3,(H2,12,13,14,15,16)
InChIKey UZVHFVZFNXBMQJ-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 224.260 g/mol
SMILES N1C(C(C(=O)NC1=O)(CC=C)CC(C)C)=O
SPLASH splash10-014i-3900000000-b4be8a2b661834f34c86
Source of Spectrum SRH-2022-3875-0
Synonyms Butalbital
Wiley ID 1826096