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Acetonitrile, [1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinylidene]-, (E)-
SpectraBase Compound ID KrhrPTXnpwO
InChI InChI=1S/C13H10N2O2/c1-9-2-4-11(5-3-9)15-12(16)8-10(6-7-14)13(15)17/h2-6H,8H2,1H3/b10-6+
InChIKey POSKQLATMWPYAJ-UXBLZVDNSA-N
Mol Weight 226.23 g/mol
Molecular Formula C13H10N2O2
Exact Mass 226.074228 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J673g0u1bRS
Name Acetonitrile, [1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinylidene]-, (E)-
CAS Registry Number 90625-62-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10N2O2
InChI InChI=1S/C13H10N2O2/c1-9-2-4-11(5-3-9)15-12(16)8-10(6-7-14)13(15)17/h2-6H,8H2,1H3/b10-6+
InChIKey POSKQLATMWPYAJ-UXBLZVDNSA-N
Molecular Weight 226.235 g/mol
SMILES C1(N(C(\C(C1)=C/C#N)=O)c1ccc(cc1)C)=O
SPLASH splash10-004i-5190000000-31515f268519fd469712
Source of Spectrum AJ-60-1493-17
Synonyms (2E)-[1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinylidene]ethanenitrile N-p-tolyl-3-(cyanomethylene)perhydropyrrol-2,5-dione (2E)-2-[1-(4-methylphenyl)-2,5-dioxo-3-pyrrolidinylidene]acetonitrile (2E)-2-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-ylidene]acetonitrile (2E)-2-[2,5-dioxo-1-(p-tolyl)pyrrolidin-3-ylidene]acetonitrile (2E)-2-[1-(4-methylphenyl)-2,5-bis(oxidanylidene)pyrrolidin-3-ylidene]ethanenitrile
Wiley ID 1227500