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(E)-3-(7-(Diethylamino)-2-oxo-2H-chromen-3-yl)acrylonitrile
SpectraBase Compound ID 5oaOZl7t2Zg
InChI InChI=1S/C16H16N2O2/c1-3-18(4-2)14-8-7-12-10-13(6-5-9-17)16(19)20-15(12)11-14/h5-8,10-11H,3-4H2,1-2H3/b6-5+
InChIKey QYJXWIQHKNHNQL-AATRIKPKSA-N
Mol Weight 268.32 g/mol
Molecular Formula C16H16N2O2
Exact Mass 268.121178 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9p0MlxmaPwq
Name (E)-3-(7-(Diethylamino)-2-oxo-2H-chromen-3-yl)acrylonitrile
Appearance Yellowish solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.121177761 u
Formula C16H16N2O2
InChI InChI=1S/C16H16N2O2/c1-3-18(4-2)14-8-7-12-10-13(6-5-9-17)16(19)20-15(12)11-14/h5-8,10-11H,3-4H2,1-2H3/b6-5+
InChIKey QYJXWIQHKNHNQL-AATRIKPKSA-N
Ionization Type EI
Literature Reference DOI 10.1021/jo302778d
Quality 66
SMILES C1=CC(=CC2=C1C=C(C(O2)=O)\C=C\C#N)N(CC)CC
SPLASH splash10-0uxr-0090000000-fc3d3a88133a206b4592
Source of Spectrum JOC-78-2962-5k (DOI: 10.1021/jo302778d)
Wiley ID 1912467