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4-[2-(phenylcarbamoyl)phenoxy]butanoic acid
SpectraBase Compound ID ICU5DB3qgoy
InChI InChI=1S/C17H17NO4/c19-16(20)11-6-12-22-15-10-5-4-9-14(15)17(21)18-13-7-2-1-3-8-13/h1-5,7-10H,6,11-12H2,(H,18,21)(H,19,20)
InChIKey CEVLWTMGKYEKMU-UHFFFAOYSA-N
Mol Weight 299.33 g/mol
Molecular Formula C17H17NO4
Exact Mass 299.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Fb3jjOWEhm
Name 4-[2-(phenylcarbamoyl)phenoxy]butanoic acid
Alternate Name(s) 4-[2-(phenylcarbamoyl)phenoxy]butyric acid 4-[2-[anilino(oxo)methyl]phenoxy]butanoic acid
Comments Less than 3 mono-isotopic peaks
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Formula C17H17NO4
InChI InChI=1S/C17H17NO4/c19-16(20)11-6-12-22-15-10-5-4-9-14(15)17(21)18-13-7-2-1-3-8-13/h1-5,7-10H,6,11-12H2,(H,18,21)(H,19,20)
InChIKey CEVLWTMGKYEKMU-UHFFFAOYSA-N
Molecular Weight 299.326 g/mol
SMILES OC(CCCOc1c(C(Nc2ccccc2)=O)cccc1)=O
SPLASH splash10-00di-0920000000-7647e7c3159f7c9d511e
Source of Spectrum QA-71-1253-7
Wiley ID 1612128