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3-[[(2-bromo-4-ethylphenyl)methoxy-oxomethyl]amino]-3-(4-methoxyphenyl)propanoic acid ethyl ester
SpectraBase Compound ID L5s9WIhvxia
InChI InChI=1S/C22H26BrNO5/c1-4-15-6-7-17(19(23)12-15)14-29-22(26)24-20(13-21(25)28-5-2)16-8-10-18(27-3)11-9-16/h6-12,20H,4-5,13-14H2,1-3H3,(H,24,26)
InChIKey PBRPWKZBQUYKLD-UHFFFAOYSA-N
Mol Weight 464.36 g/mol
Molecular Formula C22H26BrNO5
Exact Mass 463.099436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CNRcgMSgMJk
Name 3-[[(2-bromo-4-ethylphenyl)methoxy-oxomethyl]amino]-3-(4-methoxyphenyl)propanoic acid ethyl ester
Alternate Name(s) Ethyl 3-({[(2-bromo-4-ethylbenzyl)oxy]carbonyl}amino)-3-(4-methoxyphenyl)propanoate Ethyl 3-[(2-bromanyl-4-ethyl-phenyl)methoxycarbonylamino]-3-(4-methoxyphenyl)propanoate Ethyl 3-[(2-bromo-4-ethyl-phenyl)methoxycarbonylamino]-3-(4-methoxyphenyl)propanoate Ethyl 3-[(2-bromo-4-ethylphenyl)methoxycarbonylamino]-3-(4-methoxyphenyl)propanoate
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Formula C22H26BrNO5
InChI InChI=1S/C22H26BrNO5/c1-4-15-6-7-17(19(23)12-15)14-29-22(26)24-20(13-21(25)28-5-2)16-8-10-18(27-3)11-9-16/h6-12,20H,4-5,13-14H2,1-3H3,(H,24,26)
InChIKey PBRPWKZBQUYKLD-UHFFFAOYSA-N
Molecular Weight 464.356 g/mol
SMILES N(C(c1ccc(cc1)OC)CC(OCC)=O)C(=O)OCc1c(cc(cc1)CC)Br
SPLASH splash10-00di-5940000000-eded7ccfc31d9df0c350
Wiley ID 1445803