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3-[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]-3-(4-methoxyphenyl)propanoic acid ethyl ester
SpectraBase Compound ID FCMrtyc4xm5
InChI InChI=1S/C22H26ClNO5/c1-5-28-21(26)12-19(16-6-8-17(27-4)9-7-16)24-20(25)13-29-18-10-14(2)22(23)15(3)11-18/h6-11,19H,5,12-13H2,1-4H3,(H,24,25)
InChIKey TVEGNWOOONLSGT-UHFFFAOYSA-N
Mol Weight 419.91 g/mol
Molecular Formula C22H26ClNO5
Exact Mass 419.149951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1hfPEFZhGeC
Name 3-[[2-(4-chloro-3,5-dimethylphenoxy)-1-oxoethyl]amino]-3-(4-methoxyphenyl)propanoic acid ethyl ester
Alternate Name(s) Ethyl 3-[2-(4-chloranyl-3,5-dimethyl-phenoxy)ethanoylamino]-3-(4-methoxyphenyl)propanoate Ethyl 3-[[2-(4-chloro-3,5-dimethyl-phenoxy)acetyl]amino]-3-(4-methoxyphenyl)propanoate Ethyl 3-{[(4-chloro-3,5-dimethylphenoxy)acetyl]amino}-3-(4-methoxyphenyl)propanoate Ethyl 3-[[2-(4-chloro-3,5-dimethylphenoxy)acetyl]amino]-3-(4-methoxyphenyl)propanoate
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Formula C22H26ClNO5
InChI InChI=1S/C22H26ClNO5/c1-5-28-21(26)12-19(16-6-8-17(27-4)9-7-16)24-20(25)13-29-18-10-14(2)22(23)15(3)11-18/h6-11,19H,5,12-13H2,1-4H3,(H,24,25)
InChIKey TVEGNWOOONLSGT-UHFFFAOYSA-N
Molecular Weight 419.905 g/mol
SMILES N(C(c1ccc(cc1)OC)CC(OCC)=O)C(=O)COc1cc(c(c(c1)C)Cl)C
SPLASH splash10-00di-4940000000-b53c5dc0ae66bcdc89f6
Wiley ID 1445801