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Methyl 4-benzamido-3-(1-pentynyl)-benzoate
SpectraBase Compound ID 8Tr2Mi2pCHD
InChI InChI=1S/C20H19NO3/c1-3-4-6-11-16-14-17(20(23)24-2)12-13-18(16)21-19(22)15-9-7-5-8-10-15/h5,7-10,12-14H,3-4H2,1-2H3,(H,21,22)
InChIKey XLPLNRYJYDPTNT-UHFFFAOYSA-N
Mol Weight 321.38 g/mol
Molecular Formula C20H19NO3
Exact Mass 321.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9hwMita9741
Name Methyl 4-benzamido-3-(1-pentynyl)-benzoate
Alternate Name(s) Methyl 4-benzamido-3-(pent-1-yn-1-yl)benzoate
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Formula C20H19NO3
InChI InChI=1S/C20H19NO3/c1-3-4-6-11-16-14-17(20(23)24-2)12-13-18(16)21-19(22)15-9-7-5-8-10-15/h5,7-10,12-14H,3-4H2,1-2H3,(H,21,22)
InChIKey XLPLNRYJYDPTNT-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201200430
Molecular Weight 321.376 g/mol
SMILES N(c1ccc(cc1C#CCCC)C(OC)=O)C(=O)c1ccccc1
SPLASH splash10-0a6r-6952000000-38d20c360ead17ae0b4d
Source of Spectrum ASC-354-3054/SM4-4k
Wiley ID 1762784