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5-(1-Aminoethyl)salicylic acid, hydrochloride

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

5-(1-Aminoethyl)salicylic acid, hydrochloride
SpectraBase Compound ID 4v2GFj6lOVH
InChI InChI=1S/C9H11NO3.ClH/c1-5(10)6-2-3-8(11)7(4-6)9(12)13;/h2-5,11H,10H2,1H3,(H,12,13);1H
InChIKey FTIOPBDFFNIWTK-UHFFFAOYSA-N
Mol Weight 217.65 g/mol
Molecular Formula C9H12ClNO3
Exact Mass 217.050571 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID Byr4h4b23HQ
Name 5-(1-Aminoethyl)salicylic acid, hydrochloride
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 217.050570947 u
Formula C9H12ClNO3
InChI InChI=1S/C9H11NO3.ClH/c1-5(10)6-2-3-8(11)7(4-6)9(12)13;/h2-5,11H,10H2,1H3,(H,12,13);1H
InChIKey FTIOPBDFFNIWTK-UHFFFAOYSA-N
Molecular Weight 217.652 g/mol
SMILES OC=1C=CC(=CC1C(=O)O)C(N)C.Cl
Spectrum/Structure Validation Score (Raman) 0.81081