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Ethyl 3-Isatylidene Acetate

View entire compound with spectra: 1 MS (GC)

Ethyl 3-Isatylidene Acetate
SpectraBase Compound ID JNvxUZ64TyM
InChI InChI=1S/C12H11NO3/c1-2-16-11(14)7-9-8-5-3-4-6-10(8)13-12(9)15/h3-7H,2H2,1H3,(H,13,15)/b9-7+
InChIKey DBCJWPPQXWNERC-VQHVLOKHSA-N
Mol Weight 217.22 g/mol
Molecular Formula C12H11NO3
Exact Mass 217.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xsXaOtvVI
Name Ethyl 3-Isatylidene Acetate
Alternate Name(s) (2E)-2-(2-oxo-1H-indol-3-ylidene)acetic acid ethyl ester Ethyl (2E)-2-(2-oxo-1H-indol-3-ylidene)acetate Ethyl (2E)-2-(2-oxoindolin-3-ylidene)acetate Ethyl (2E)-2-(2-oxidanylidene-1H-indol-3-ylidene)ethanoate
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Formula C12H11NO3
InChI InChI=1S/C12H11NO3/c1-2-16-11(14)7-9-8-5-3-4-6-10(8)13-12(9)15/h3-7H,2H2,1H3,(H,13,15)/b9-7+
InChIKey DBCJWPPQXWNERC-VQHVLOKHSA-N
Molecular Weight 217.224 g/mol
SMILES N1c2c(\C(C1=O)=C\C(=O)OCC)cccc2
SPLASH splash10-014i-1920000000-0502ba85a73a681b7d1f
Source of Spectrum G4-60-1153-4
Wiley ID 1606958