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Methyl 4-benzamido-3-ethynyl-benzoate
SpectraBase Compound ID 7A3F1hoYlWI
InChI InChI=1S/C17H13NO3/c1-3-12-11-14(17(20)21-2)9-10-15(12)18-16(19)13-7-5-4-6-8-13/h1,4-11H,2H3,(H,18,19)
InChIKey CBNYGQQQKNKOFH-UHFFFAOYSA-N
Mol Weight 279.29 g/mol
Molecular Formula C17H13NO3
Exact Mass 279.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C3grQDA2U0v
Name Methyl 4-benzamido-3-ethynyl-benzoate
Alternate Name(s) Methyl 4-benzamido-3-ethynylbenzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13NO3
InChI InChI=1S/C17H13NO3/c1-3-12-11-14(17(20)21-2)9-10-15(12)18-16(19)13-7-5-4-6-8-13/h1,4-11H,2H3,(H,18,19)
InChIKey CBNYGQQQKNKOFH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201200430
Molecular Weight 279.295 g/mol
SMILES N(c1ccc(cc1C#C)C(OC)=O)C(c1ccccc1)=O
SPLASH splash10-0a6r-4910000000-2cbe93392e52ab8f4113
Source of Spectrum ASC-354-3054/SM3-4i
Wiley ID 1762782