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Methyl (E)-2-(1-acetyl-1H-indol-3-yl)-2-((2-cyanophenyl)imino)acetate
SpectraBase Compound ID 9D9DYx9wicA
InChI InChI=1S/C20H15N3O3/c1-13(24)23-12-16(15-8-4-6-10-18(15)23)19(20(25)26-2)22-17-9-5-3-7-14(17)11-21/h3-10,12H,1-2H3/b22-19+
InChIKey CCEAMKQIZXGZEZ-ZBJSNUHESA-N
Mol Weight 345.36 g/mol
Molecular Formula C20H15N3O3
Exact Mass 345.111341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2FDm4Qk0HlP
Name Methyl (E)-2-(1-acetyl-1H-indol-3-yl)-2-((2-cyanophenyl)imino)acetate
Appearance Yellow crystals
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Formula C20H15N3O3
InChI InChI=1S/C20H15N3O3/c1-13(24)23-12-16(15-8-4-6-10-18(15)23)19(20(25)26-2)22-17-9-5-3-7-14(17)11-21/h3-10,12H,1-2H3/b22-19+
InChIKey CCEAMKQIZXGZEZ-ZBJSNUHESA-N
Instrument Name Thermo FinninganTSQ 700
Ionization Type EI
Literature Reference DOI 10.1002/chem.201805909
Molecular Weight 345.358 g/mol
Reported Formula C20H15N3
SMILES COC(\C(=N\c1c(cccc1)C#N)c1c[n](c2c1cccc2)C(C)=O)=O
SPLASH splash10-0udj-0009000000-4173d7f4a35ad2db7a2b
Source of Spectrum QE-25-SM18-S36
Wiley ID 1848416