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3-[(4-fluorobenzoyl)amino]-3-(4-isopropoxyphenyl)propanoic acid
SpectraBase Compound ID 9GM4NmesRpw
InChI InChI=1S/C19H20FNO4/c1-12(2)25-16-9-5-13(6-10-16)17(11-18(22)23)21-19(24)14-3-7-15(20)8-4-14/h3-10,12,17H,11H2,1-2H3,(H,21,24)(H,22,23)
InChIKey SOFQXERJWDXQTP-UHFFFAOYSA-N
Mol Weight 345.37 g/mol
Molecular Formula C19H20FNO4
Exact Mass 345.137636 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9T6rXYM070r
Name 3-[(4-fluorobenzoyl)amino]-3-(4-isopropoxyphenyl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20FNO4
InChI InChI=1S/C19H20FNO4/c1-12(2)25-16-9-5-13(6-10-16)17(11-18(22)23)21-19(24)14-3-7-15(20)8-4-14/h3-10,12,17H,11H2,1-2H3,(H,21,24)(H,22,23)
InChIKey SOFQXERJWDXQTP-UHFFFAOYSA-N
Molecular Weight 345.370 g/mol
SMILES OC(CC(c1ccc(cc1)OC(C)C)NC(=O)c1ccc(cc1)F)=O
SPLASH splash10-00dl-9710000000-6e74b599ba39898d516d
Synonyms 3-[(4-fluorobenzoyl)amino]-3-(4-propan-2-yloxyphenyl)propanoic acid 3-[(4-fluorophenyl)carbonylamino]-3-(4-propan-2-yloxyphenyl)propanoic acid 3-[[(4-fluorophenyl)-oxomethyl]amino]-3-(4-propan-2-yloxyphenyl)propanoic acid
Wiley ID 1443940