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(4-Pentenoylamino)(phenyl)acetic acid

View entire compound with spectra: 2 MS (GC)

(4-Pentenoylamino)(phenyl)acetic acid
SpectraBase Compound ID IYY79zZ4UCQ
InChI InChI=1S/C13H15NO3/c1-2-3-9-11(15)14-12(13(16)17)10-7-5-4-6-8-10/h2,4-8,12H,1,3,9H2,(H,14,15)(H,16,17)
InChIKey SRHIUAQOCOMBNU-UHFFFAOYSA-N
Mol Weight 233.27 g/mol
Molecular Formula C13H15NO3
Exact Mass 233.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Ow88lzfnYx
Name (4-Pentenoylamino)(phenyl)acetic acid
Alternate Name(s) .alpha.-Aminobenzeneacetic acid, N-pent-4-enoyl- 2-(1-oxopent-4-enylamino)-2-phenylacetic acid 2-(pent-4-enoylamino)-2-phenyl-acetic acid 2-(pent-4-enoylamino)-2-phenyl-ethanoic acid
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Formula C13H15NO3
InChI InChI=1S/C13H15NO3/c1-2-3-9-11(15)14-12(13(16)17)10-7-5-4-6-8-10/h2,4-8,12H,1,3,9H2,(H,14,15)(H,16,17)
InChIKey SRHIUAQOCOMBNU-UHFFFAOYSA-N
Molecular Weight 233.267 g/mol
SMILES N(C(CCC=C)=O)C(C(=O)O)c1ccccc1
SPLASH splash10-0a4i-6900000000-d15de4820e676bfee9dd
Wiley ID 1474472