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(E)-3-(3-(4-Methoxyphenyl)prop-2-yn-1-ylidene)indolin-2-one
SpectraBase Compound ID 5J1QsM916u7
InChI InChI=1S/C18H13NO2/c1-21-14-11-9-13(10-12-14)5-4-7-16-15-6-2-3-8-17(15)19-18(16)20/h2-3,6-12H,1H3,(H,19,20)/b16-7+
InChIKey DNEFVVINJAIBFU-FRKPEAEDSA-N
Mol Weight 275.31 g/mol
Molecular Formula C18H13NO2
Exact Mass 275.094629 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LlnXluIaRKc
Name (E)-3-(3-(4-Methoxyphenyl)prop-2-yn-1-ylidene)indolin-2-one
Appearance Yellow crystals
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Exact Mass 275.094628661 u
Formula C18H13NO2
InChI InChI=1S/C18H13NO2/c1-21-14-11-9-13(10-12-14)5-4-7-16-15-6-2-3-8-17(15)19-18(16)20/h2-3,6-12H,1H3,(H,19,20)/b16-7+
InChIKey DNEFVVINJAIBFU-FRKPEAEDSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201802237
Molecular Weight 275.307 g/mol
Quality 72
Reported Formula C18H13NO2
SMILES N1C2=C(\C(C1=O)=C\C#CC1=CC=C(OC)C=C1)C=CC=C2
SPLASH splash10-004i-0090000000-4ddbd6eb648be91a37f8
Source of Spectrum QE-24-SM18-15 (DOI: 10.1002/chem.201802237)
Wiley ID 1901705