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7-(Diethylamino)-4-(phenylethynyl)-2H-chromen-2-one
SpectraBase Compound ID 4cPCJWMpYE0
InChI InChI=1S/C21H19NO2/c1-3-22(4-2)18-12-13-19-17(14-21(23)24-20(19)15-18)11-10-16-8-6-5-7-9-16/h5-9,12-15H,3-4H2,1-2H3
InChIKey IAPJYAXNKWONKN-UHFFFAOYSA-N
Mol Weight 317.39 g/mol
Molecular Formula C21H19NO2
Exact Mass 317.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9vmRjLo5AmV
Name 7-(Diethylamino)-4-(phenylethynyl)-2H-chromen-2-one
Appearance Orange solid
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Exact Mass 317.141578854 u
Formula C21H19NO2
InChI InChI=1S/C21H19NO2/c1-3-22(4-2)18-12-13-19-17(14-21(23)24-20(19)15-18)11-10-16-8-6-5-7-9-16/h5-9,12-15H,3-4H2,1-2H3
InChIKey IAPJYAXNKWONKN-UHFFFAOYSA-N
Instrument Name Finnigan MAR
Ionization Type EI
Literature Reference DOI 10.1002/chem.201704912
Molecular Weight 317.388 g/mol
Quality 230
SMILES C(C)N(CC)C=1C=CC2=C(C1)OC(C=C2C#CC1=CC=CC=C1)=O
SPLASH splash10-0uxr-0019000000-bb99403513b96faec72f
Source of Spectrum QE-24-SM8-4f (DOI: 10.1002/chem.201704912)
Thin-Layer Chromatography 0.25 (n-hexane/ethyl acetate, 3:1)
Wiley ID 1900295