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Ethyl-3-((3-(1H-indol-3-yl)-1H-pyrazol-5-yl)amino)-2-cyanoacrylate
SpectraBase Compound ID KYPOLpFxtlp
InChI InChI=1S/C17H15N5O2/c1-2-24-17(23)11(8-18)9-20-16-7-15(21-22-16)13-10-19-14-6-4-3-5-12(13)14/h3-7,9-10,19H,2H2,1H3,(H2,20,21,22)
InChIKey MWEBDJYNGXJUEG-UHFFFAOYSA-N
Mol Weight 321.34 g/mol
Molecular Formula C17H15N5O2
Exact Mass 321.122575 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 66XNpN5UBTb
Name Ethyl-3-((3-(1H-indol-3-yl)-1H-pyrazol-5-yl)amino)-2-cyanoacrylate
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15N5O2
InChI InChI=1S/C17H15N5O2/c1-2-24-17(23)11(8-18)9-20-16-7-15(21-22-16)13-10-19-14-6-4-3-5-12(13)14/h3-7,9-10,19H,2H2,1H3,(H2,20,21,22)
InChIKey MWEBDJYNGXJUEG-UHFFFAOYSA-N
Instrument Name Finnigan MAT 212
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3288
Molecular Weight 321.340 g/mol
SMILES N(C=C(C(OCC)=O)C#N)c1cc(-c2c[nH]c3ccccc23)n[nH]1
SPLASH splash10-00b9-1197000000-8911cdefb5c8983d3590
Source of Spectrum Y-55-2306-4
Wiley ID 1878840