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IIUYXCNZPYPQOI-GQCTYLIASA-N
SpectraBase Compound ID 6tNOLdF239w
InChI InChI=1S/C7H7N3O3/c1-13-7(12)4(2-8)6-9-3-5(11)10-6/h9H,3H2,1H3,(H,10,11)/b6-4+
InChIKey IIUYXCNZPYPQOI-GQCTYLIASA-N
Mol Weight 181.15 g/mol
Molecular Formula C7H7N3O3
Exact Mass 181.048741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LVmo0YqFMWs
Name Methyl 2-cyano-2-(4-oxo-2-imidazolidinylidene)acetate
CAS Registry Number 127855-57-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7N3O3
InChI InChI=1S/C7H7N3O3/c1-13-7(12)4(2-8)6-9-3-5(11)10-6/h9H,3H2,1H3,(H,10,11)/b6-4+
InChIKey IIUYXCNZPYPQOI-GQCTYLIASA-N
Molecular Weight 181.151 g/mol
SMILES N1C(CN\C1=C\(C(=O)OC)C#N)=O
SPLASH splash10-001i-0900000000-d0c020a7de0ffafedfbf
Source of Spectrum K-123-2205-5
Synonyms Methyl (2E)-cyano(4-oxo-2-imidazolidinylidene)ethanoate
Wiley ID 1177232