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(E)-(n)-Butyl 3-(2-acetamido-5-methylphenyl)acrylate
SpectraBase Compound ID KCdZmTWEF1S
InChI InChI=1S/C16H21NO3/c1-4-5-10-20-16(19)9-7-14-11-12(2)6-8-15(14)17-13(3)18/h6-9,11H,4-5,10H2,1-3H3,(H,17,18)/b9-7+
InChIKey JJHRXLQPCLKXQK-VQHVLOKHSA-N
Mol Weight 275.35 g/mol
Molecular Formula C16H21NO3
Exact Mass 275.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I3U5f25WAwI
Name (E)-(n)-Butyl 3-(2-acetamido-5-methylphenyl)acrylate
Alternate Name(s) (E)-butyl 3-(2-acetamido-5-methylphenyl)acrylate (E)-3-(2-acetamido-5-methylphenyl)-2-propenoic acid butyl ester Butyl (E)-3-(2-acetamido-5-methylphenyl)prop-2-enoate Butyl (E)-3-(2-acetamido-5-methyl-phenyl)prop-2-enoate
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Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-4-5-10-20-16(19)9-7-14-11-12(2)6-8-15(14)17-13(3)18/h6-9,11H,4-5,10H2,1-3H3,(H,17,18)/b9-7+
InChIKey JJHRXLQPCLKXQK-VQHVLOKHSA-N
Literature Reference DOI 10.1021/ol203251s
Molecular Weight 275.348 g/mol
SMILES N(c1c(\C=C\C(=O)OCCCC)cc(cc1)C)C(=O)C
SPLASH splash10-03e9-0920000000-679de42bf70afd9529aa
Source of Spectrum A1-14-728/SMS12-3cb
Wiley ID 1750001