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1H-Pyrrole-2,5-dione, 3-methyl-4-(1-methylpropyl)-
SpectraBase Compound ID IUjSAfIgPHO
InChI InChI=1S/C9H13NO2/c1-4-5(2)7-6(3)8(11)10-9(7)12/h5H,4H2,1-3H3,(H,10,11,12)
InChIKey UYMTWAIKJKBNNY-UHFFFAOYSA-N
Mol Weight 167.21 g/mol
Molecular Formula C9H13NO2
Exact Mass 167.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5I4hPaDmxeg
Name 1H-Pyrrole-2,5-dione, 3-methyl-4-(1-methylpropyl)-
Alternate Name(s) 3-Methyl-4-sec-butyl-1H-pyrrole-2,5-dione 3-sec-butyl-4-methyl-1H-pyrrole-2,5-dione
CAS Registry Number 77586-82-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO2
InChI InChI=1S/C9H13NO2/c1-4-5(2)7-6(3)8(11)10-9(7)12/h5H,4H2,1-3H3,(H,10,11,12)
InChIKey UYMTWAIKJKBNNY-UHFFFAOYSA-N
Molecular Weight 167.208 g/mol
SMILES N1C(C(=C(C1=O)C(CC)C)C)=O
SPLASH splash10-016r-5900000000-d4ea49188e2966507678
Source of Spectrum F-36-3264-3
Wiley ID 1163590