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3-[(3,5-dimethoxybenzoyl)amino]-3-(4-propoxyphenyl)propanoic acid
SpectraBase Compound ID DOmv6yvq1hd
InChI InChI=1S/C21H25NO6/c1-4-9-28-16-7-5-14(6-8-16)19(13-20(23)24)22-21(25)15-10-17(26-2)12-18(11-15)27-3/h5-8,10-12,19H,4,9,13H2,1-3H3,(H,22,25)(H,23,24)
InChIKey UWPYYFYCNNPJNK-UHFFFAOYSA-N
Mol Weight 387.43 g/mol
Molecular Formula C21H25NO6
Exact Mass 387.168188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AzYAUuPynbM
Name 3-[(3,5-dimethoxybenzoyl)amino]-3-(4-propoxyphenyl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO6
InChI InChI=1S/C21H25NO6/c1-4-9-28-16-7-5-14(6-8-16)19(13-20(23)24)22-21(25)15-10-17(26-2)12-18(11-15)27-3/h5-8,10-12,19H,4,9,13H2,1-3H3,(H,22,25)(H,23,24)
InChIKey UWPYYFYCNNPJNK-UHFFFAOYSA-N
Molecular Weight 387.432 g/mol
SMILES N(C(c1cc(OC)cc(c1)OC)=O)C(CC(=O)O)c1ccc(cc1)OCCC
SPLASH splash10-00xu-7920000000-6003f5e3e8b75316a05b
Synonyms 3-[(3,5-dimethoxyphenyl)carbonylamino]-3-(4-propoxyphenyl)propanoic acid 3-[[(3,5-dimethoxyphenyl)-oxomethyl]amino]-3-(4-propoxyphenyl)propanoic acid
Wiley ID 1444211