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3-[(2,4-dimethoxybenzoyl)amino]-3-(4-propoxyphenyl)propanoic acid
SpectraBase Compound ID GOLMg4aVX0Z
InChI InChI=1S/C21H25NO6/c1-4-11-28-15-7-5-14(6-8-15)18(13-20(23)24)22-21(25)17-10-9-16(26-2)12-19(17)27-3/h5-10,12,18H,4,11,13H2,1-3H3,(H,22,25)(H,23,24)
InChIKey YHLTXFOBVQPZDH-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 1i9zgsemQha
Name 3-[(2,4-dimethoxybenzoyl)amino]-3-(4-propoxyphenyl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25NO6
InChI InChI=1S/C21H25NO6/c1-4-11-28-15-7-5-14(6-8-15)18(13-20(23)24)22-21(25)17-10-9-16(26-2)12-19(17)27-3/h5-10,12,18H,4,11,13H2,1-3H3,(H,22,25)(H,23,24)
InChIKey YHLTXFOBVQPZDH-UHFFFAOYSA-N
Molecular Weight 387.432 g/mol
SMILES N(C(c1c(cc(cc1)OC)OC)=O)C(CC(=O)O)c1ccc(cc1)OCCC
SPLASH splash10-01bc-8910000000-353fb5b0bfd9a231f8f7
Synonyms 3-[(2,4-dimethoxyphenyl)carbonylamino]-3-(4-propoxyphenyl)propanoic acid 3-[[(2,4-dimethoxyphenyl)-oxomethyl]amino]-3-(4-propoxyphenyl)propanoic acid
Wiley ID 1444210