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2-(3-Nitrophenyl)-2-oxoethyl 3-phenylpropiolate
SpectraBase Compound ID Kj2VGOirSzt
InChI InChI=1S/C17H11NO5/c19-16(14-7-4-8-15(11-14)18(21)22)12-23-17(20)10-9-13-5-2-1-3-6-13/h1-8,11H,12H2
InChIKey IEYDGAWVRRDECQ-UHFFFAOYSA-N
Mol Weight 309.28 g/mol
Molecular Formula C17H11NO5
Exact Mass 309.063722 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 947TEfgZxaA
Name 2-(3-Nitrophenyl)-2-oxoethyl 3-phenylpropiolate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H11NO5
InChI InChI=1S/C17H11NO5/c19-16(14-7-4-8-15(11-14)18(21)22)12-23-17(20)10-9-13-5-2-1-3-6-13/h1-8,11H,12H2
InChIKey IEYDGAWVRRDECQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000762
Molecular Weight 309.277 g/mol
SMILES C(C#Cc1ccccc1)(=O)OCC(=O)c1cc(ccc1)[N+](=O)[O-]
SPLASH splash10-004i-0900000000-2a64eb3b9c721c495f97
Source of Spectrum ASC-353-31/SM6-1h
Wiley ID 1764646