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Methyl 3-(2-phenylethynyl)benzoate

View entire compound with spectra: 2 MS (GC)

Methyl 3-(2-phenylethynyl)benzoate
SpectraBase Compound ID C7Lmtb8KYEI
InChI InChI=1S/C16H12O2/c1-18-16(17)15-9-5-8-14(12-15)11-10-13-6-3-2-4-7-13/h2-9,12H,1H3
InChIKey DIOFUMRRFPINEJ-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C16H12O2
Exact Mass 236.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hp38o8pdOt5
Name Methyl 3-(2-phenylethynyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O2
InChI InChI=1S/C16H12O2/c1-18-16(17)15-9-5-8-14(12-15)11-10-13-6-3-2-4-7-13/h2-9,12H,1H3
InChIKey DIOFUMRRFPINEJ-UHFFFAOYSA-N
Molecular Weight 236.270 g/mol
SMILES C(#Cc1ccccc1)c1cc(C(=O)OC)ccc1
SPLASH splash10-000i-2790000000-afa334a7c181db9ed592
Source of Spectrum AT-39-3012-3
Synonyms Methyl 3-phenylethynylbenzoate 3-(2-phenylethynyl)benzoic acid methyl ester Methyl 3-(phenylethynyl)benzoate
Wiley ID 854184