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3-(hexadecyloxy)-4-nitrobenzoic acid

View entire compound with spectra: 3 NMR, and 1 FTIR

3-(hexadecyloxy)-4-nitrobenzoic acid
SpectraBase Compound ID JKtOumhASbX
InChI InChI=1S/C23H37NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-29-22-19-20(23(25)26)16-17-21(22)24(27)28/h16-17,19H,2-15,18H2,1H3,(H,25,26)
InChIKey WFZONRGQXORMQG-UHFFFAOYSA-N
Mol Weight 407.6 g/mol
Molecular Formula C23H37NO5
Exact Mass 407.267173 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3sO8V7jHeNU
Name 3-(HEXADECYLOXY)-4-NITROBENZOIC ACID
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H37NO5
InChI InChI=1S/C23H37NO5/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-29-22-19-20(23(25)26)16-17-21(22)24(27)28/h16-17,19H,2-15,18H2,1H3,(H,25,26)
InChIKey WFZONRGQXORMQG-UHFFFAOYSA-N
Molecular Weight 407.55
Solvent Dimethyl sulfoxide-d6; Reference=TMS Spectrometer= Bruker AC-300
Synonyms BENZOIC ACID, 3-/HEXADECYLOXY/-4-NITRO-,