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4-(Fmoc-aminomethyl)benzoic acid

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

4-(Fmoc-aminomethyl)benzoic acid
SpectraBase Compound ID JzhaI3kFLgW
InChI InChI=1S/C23H19NO4/c25-22(26)16-11-9-15(10-12-16)13-24-23(27)28-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21H,13-14H2,(H,24,27)(H,25,26)
InChIKey JRHUROPSUJVMNH-UHFFFAOYSA-N
Mol Weight 373.41 g/mol
Molecular Formula C23H19NO4
Exact Mass 373.131408 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID C0mK5sH2XPH
Name 4-(Fmoc-aminomethyl)benzoic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 373.131408092 u
Formula C23H19NO4
InChI InChI=1S/C23H19NO4/c25-22(26)16-11-9-15(10-12-16)13-24-23(27)28-14-21-19-7-3-1-5-17(19)18-6-2-4-8-20(18)21/h1-12,21H,13-14H2,(H,24,27)(H,25,26)
InChIKey JRHUROPSUJVMNH-UHFFFAOYSA-N
Molecular Weight 373.408 g/mol
SMILES OC(C=1C=CC(CNC(OCC2C=3C=CC=CC3C=3C=CC=CC23)=O)=CC1)=O
Spectrum/Structure Validation Score (Raman) 0.772765