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Ethyl isocyanatoacetate
SpectraBase Compound ID IXNdKVMuh2P
InChI InChI=1S/C5H7NO3/c1-2-9-5(8)3-6-4-7/h2-3H2,1H3
InChIKey DUVOZUPPHBRJJO-UHFFFAOYSA-N
Mol Weight 129.11 g/mol
Molecular Formula C5H7NO3
Exact Mass 129.042593 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3oQ2trqpwPs
Name Acetic acid, isocyanato-, ethyl ester
Alternate Name(s) 2-isocyanatoacetic acid ethyl ester Carbethoxymethyl isocyanate Ethoxycarbonylmethyl isocyanate Ethyl 2-isocyanatoacetate Ethyl 2-isocyanatoethanoate Ethyl glycolate isocyanate Ethyl isocyanatoacetate Ethyl N-(oxomethylene)glycinate Isocyanatoacetic acid ethyl ester Isocyanatoethyl acetate AI3-52377 EINECS 220-967-4 NSC 56429 NSC 6276
CAS Registry Number 2949-22-6
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Formula C5H7NO3
InChI InChI=1S/C5H7NO3/c1-2-9-5(8)3-6-4-7/h2-3H2,1H3
InChIKey DUVOZUPPHBRJJO-UHFFFAOYSA-N
Molecular Weight 129.115 g/mol
SMILES C(N=C=O)C(=O)OCC
SPLASH splash10-0a4i-9000000000-719dc07724474b0e2c8b
Source of Spectrum W6-4122-0-0
Wiley ID 81540