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4-[4-(diisopropylcarbamoyl)benzoyl]benzoic acid
SpectraBase Compound ID AtVKOOpXtTc
InChI InChI=1S/C21H23NO4/c1-13(2)22(14(3)4)20(24)17-9-5-15(6-10-17)19(23)16-7-11-18(12-8-16)21(25)26/h5-14H,1-4H3,(H,25,26)
InChIKey ALTLVJFHPCSAMR-UHFFFAOYSA-N
Mol Weight 353.42 g/mol
Molecular Formula C21H23NO4
Exact Mass 353.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AiRSdDGVBS5
Name 4-[4-(diisopropylcarbamoyl)benzoyl]benzoic acid
Alternate Name(s) 4-[4-[di(propan-2-yl)carbamoyl]benzoyl]benzoic acid 4-[4-[di(propan-2-yl)carbamoyl]phenyl]carbonylbenzoic acid 4-[[4-[[di(propan-2-yl)amino]-oxomethyl]phenyl]-oxomethyl]benzoic acid
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Formula C21H23NO4
InChI InChI=1S/C21H23NO4/c1-13(2)22(14(3)4)20(24)17-9-5-15(6-10-17)19(23)16-7-11-18(12-8-16)21(25)26/h5-14H,1-4H3,(H,25,26)
InChIKey ALTLVJFHPCSAMR-UHFFFAOYSA-N
Molecular Weight 353.418 g/mol
SMILES OC(c1ccc(C(c2ccc(C(N(C(C)C)C(C)C)=O)cc2)=O)cc1)=O
SPLASH splash10-0udi-0096000000-2ea7f502dba60933af1d
Source of Spectrum D9-335-86-4
Wiley ID 1550911