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2-[(4-Acetyl-3,5-dimethyl-1H-pyrrol-2-yl)methylene]malononitrile
SpectraBase Compound ID 6XkMjXVkZcc
InChI InChI=1S/C12H11N3O/c1-7-11(4-10(5-13)6-14)15-8(2)12(7)9(3)16/h4,15H,1-3H3
InChIKey UXMSQVHYNAOBPN-UHFFFAOYSA-N
Mol Weight 213.24 g/mol
Molecular Formula C12H11N3O
Exact Mass 213.090212 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gor47sqreCy
Name 2-[(4-Acetyl-3,5-dimethyl-1H-pyrrol-2-yl)methylene]malononitrile
CAS Registry Number 91396-90-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11N3O
InChI InChI=1S/C12H11N3O/c1-7-11(4-10(5-13)6-14)15-8(2)12(7)9(3)16/h4,15H,1-3H3
InChIKey UXMSQVHYNAOBPN-UHFFFAOYSA-N
Molecular Weight 213.240 g/mol
SMILES [nH]1c(c(c(c1C)C(=O)C)C)C=C(C#N)C#N
SPLASH splash10-0002-4930000000-b29989ff322878eef8ce
Source of Spectrum AD-0-2532-0
Synonyms 2-[(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)methylene]propanedinitrile 2-[(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)methylidene]propanedinitrile 2-[(4-ethanoyl-3,5-dimethyl-1H-pyrrol-2-yl)methylidene]propanedinitrile Propanedinitrile, 2-(4-acetyl-3,5-dimethyl-2-pyrrolyl)methylene-
Wiley ID 1430003