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3-(4-tert-butylphenyl)-3-[(2-fluorobenzoyl)amino]propanoic acid
SpectraBase Compound ID LLZTwXMtwQ6
InChI InChI=1S/C20H22FNO3/c1-20(2,3)14-10-8-13(9-11-14)17(12-18(23)24)22-19(25)15-6-4-5-7-16(15)21/h4-11,17H,12H2,1-3H3,(H,22,25)(H,23,24)
InChIKey WQVKUGIYCFULAW-UHFFFAOYSA-N
Mol Weight 343.4 g/mol
Molecular Formula C20H22FNO3
Exact Mass 343.158372 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LGm2KySbguE
Name 3-(4-tert-butylphenyl)-3-[(2-fluorobenzoyl)amino]propanoic acid
Alternate Name(s) 3-(4-tert-butylphenyl)-3-[(2-fluorobenzoyl)amino]propionic acid 3-(4-tert-butylphenyl)-3-[(2-fluorophenyl)carbonylamino]propanoic acid 3-(4-tert-butylphenyl)-3-[[(2-fluorophenyl)-oxomethyl]amino]propanoic acid Propionic acid, 3-(4-tert-butylphenyl)-3-(2-fluorobenzoylamino)-
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Formula C20H22FNO3
InChI InChI=1S/C20H22FNO3/c1-20(2,3)14-10-8-13(9-11-14)17(12-18(23)24)22-19(25)15-6-4-5-7-16(15)21/h4-11,17H,12H2,1-3H3,(H,22,25)(H,23,24)
InChIKey WQVKUGIYCFULAW-UHFFFAOYSA-N
Molecular Weight 343.398 g/mol
SMILES OC(CC(c1ccc(cc1)C(C)(C)C)NC(=O)c1c(cccc1)F)=O
SPLASH splash10-00di-3940000000-aea1471c57e25cd64dd8
Wiley ID 1445934