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2-[3-(4-METHYLPHENYLSUFONAMIDO)-PENTYL]-BENZOIC-ACID

View entire compound with spectra: 1 NMR

2-[3-(4-METHYLPHENYLSUFONAMIDO)-PENTYL]-BENZOIC-ACID
SpectraBase Compound ID BTYdlJWMyoX
InChI InChI=1S/C19H23NO5S/c1-3-16(11-10-15-6-4-5-7-18(15)19(21)22)20-25-26(23,24)17-12-8-14(2)9-13-17/h4-9,12-13,16,20H,3,10-11H2,1-2H3,(H,21,22)
InChIKey OVVWNPGOPJQQCX-UHFFFAOYSA-N
Mol Weight 377.46 g/mol
Molecular Formula C19H23NO5S
Exact Mass 377.129694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JAsdq94SbeK
Name 2-[3-(4-METHYLPHENYLSUFONAMIDO)-PENTYL]-BENZOIC-ACID
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23NO5S
InChI InChI=1S/C19H23NO5S/c1-3-16(11-10-15-6-4-5-7-18(15)19(21)22)20-25-26(23,24)17-12-8-14(2)9-13-17/h4-9,12-13,16,20H,3,10-11H2,1-2H3,(H,21,22)
InChIKey OVVWNPGOPJQQCX-UHFFFAOYSA-N
Literature Reference Author A.M.COSTERO,S.GIL,M.PARRA,P.RODRIGUEZ
Literature Reference Citation MOLECULES,15,9135(2010)
Literature Reference DOI 10.3390/molecules15129135
Molecular Weight 377.455 g/mol
Sample ID 72766
Solvent CDCl3