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5-(2-formamidophenyl)-4-pentynoic acid ethyl ester
SpectraBase Compound ID ABmosVDItEa
InChI InChI=1S/C14H15NO3/c1-2-18-14(17)10-6-4-8-12-7-3-5-9-13(12)15-11-16/h3,5,7,9,11H,2,6,10H2,1H3,(H,15,16)
InChIKey XCQMCUGHHVKEJQ-UHFFFAOYSA-N
Mol Weight 245.28 g/mol
Molecular Formula C14H15NO3
Exact Mass 245.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HavuZfqJ2kW
Name 5-(2-formamidophenyl)-4-pentynoic acid ethyl ester
Alternate Name(s) 5-(2-formamidophenyl)pent-4-ynoic acid ethyl ester Ethyl 5-(2-formamidophenyl)pent-4-ynoate
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Formula C14H15NO3
InChI InChI=1S/C14H15NO3/c1-2-18-14(17)10-6-4-8-12-7-3-5-9-13(12)15-11-16/h3,5,7,9,11H,2,6,10H2,1H3,(H,15,16)
InChIKey XCQMCUGHHVKEJQ-UHFFFAOYSA-N
Molecular Weight 245.278 g/mol
SMILES N(c1c(C#CCCC(=O)OCC)cccc1)C=O
SPLASH splash10-0005-0590000000-ddb5466e8684c0065be8
Source of Spectrum KC-0-532-1
Wiley ID 827432