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3-amino-4-(hexadecylthio)benzoic acid, methyl ester
SpectraBase Compound ID 8cdpY4n03DW
InChI InChI=1S/C24H41NO2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-28-23-18-17-21(20-22(23)25)24(26)27-2/h17-18,20H,3-16,19,25H2,1-2H3
InChIKey UQOIPLDNHUTFHX-UHFFFAOYSA-N
Mol Weight 407.7 g/mol
Molecular Formula C24H41NO2S
Exact Mass 407.285801 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BjUf01as8WC
Name 3-amino-4-(hexadecylthio)benzoic acid, methyl ester
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H41NO2S
InChI InChI=1S/C24H41NO2S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-28-23-18-17-21(20-22(23)25)24(26)27-2/h17-18,20H,3-16,19,25H2,1-2H3
InChIKey UQOIPLDNHUTFHX-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 52011M
Solvent CDCl3