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Benzonitrile, 4-[[(2.5-dioxo-1-pyrrolidinyl)oxy]carbonyl]-
SpectraBase Compound ID KuTfbCoazdi
InChI InChI=1S/C12H8N2O4/c13-7-8-1-3-9(4-2-8)12(17)18-14-10(15)5-6-11(14)16/h1-4H,5-6H2
InChIKey CCMXELFRCBTHNV-UHFFFAOYSA-N
Mol Weight 244.21 g/mol
Molecular Formula C12H8N2O4
Exact Mass 244.048407 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9joHPFKcJu6
Name Benzonitrile, 4-[[(2.5-dioxo-1-pyrrolidinyl)oxy]carbonyl]-
CAS Registry Number 99300-38-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8N2O4
InChI InChI=1S/C12H8N2O4/c13-7-8-1-3-9(4-2-8)12(17)18-14-10(15)5-6-11(14)16/h1-4H,5-6H2
InChIKey CCMXELFRCBTHNV-UHFFFAOYSA-N
Molecular Weight 244.206 g/mol
SMILES C1(=O)CCC(=O)N1OC(=O)c1ccc(C#N)cc1
SPLASH splash10-001i-2900000000-63772b39c6638800b07b
Source of Spectrum JX-2015-1-412
Synonyms 2,5-Dioxopyrrolidin-1-yl 4-cyanobenzoate 4-Cyanobenzoic acid (2,5-dioxo-1-pyrrolidinyl) ester (2,5-dioxopyrrolidin-1-yl) 4-cyanobenzoate [2,5-bis(oxidanylidene)pyrrolidin-1-yl] 4-cyanobenzoate
Wiley ID 1721245