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2-(4-Chlorophenyl)-2-oxoethyl 3-p-tolylpropiolate
SpectraBase Compound ID 8ftUmWTuIlo
InChI InChI=1S/C18H13ClO3/c1-13-2-4-14(5-3-13)6-11-18(21)22-12-17(20)15-7-9-16(19)10-8-15/h2-5,7-10H,12H2,1H3
InChIKey FOAVHELASWWOEW-UHFFFAOYSA-N
Mol Weight 312.75 g/mol
Molecular Formula C18H13ClO3
Exact Mass 312.055322 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4YBIASZ4hU
Name 2-(4-Chlorophenyl)-2-oxoethyl 3-p-tolylpropiolate
Alternate Name(s) 2-(4-Chlorophenyl)-2-oxoethyl 3-(p-tolyl)propiolate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13ClO3
InChI InChI=1S/C18H13ClO3/c1-13-2-4-14(5-3-13)6-11-18(21)22-12-17(20)15-7-9-16(19)10-8-15/h2-5,7-10H,12H2,1H3
InChIKey FOAVHELASWWOEW-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000762
Molecular Weight 312.752 g/mol
SMILES C(C#Cc1ccc(cc1)C)(=O)OCC(=O)c1ccc(cc1)Cl
SPLASH splash10-000l-0900000000-432db68d12c868466dea
Source of Spectrum ASC-353-31/SM7-1j
Wiley ID 1764648