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1-Naphthylamine, 2-chloropropionate

View entire compound with spectra: 1 NMR, 1 Raman, and 3 UV-Vis

1-Naphthylamine, 2-chloropropionate
SpectraBase Compound ID BKNPdITKs6y
InChI InChI=1S/C10H9N.C3H5ClO2/c11-10-7-3-5-8-4-1-2-6-9(8)10;1-2(4)3(5)6/h1-7H,11H2;2H,1H3,(H,5,6)
InChIKey TWNCTWABIARSJY-UHFFFAOYSA-N
Mol Weight 251.71 g/mol
Molecular Formula C13H14ClNO2
Exact Mass 251.071306 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID L66AY4l8fN3
Name 1-Naphthylamine, 2-chloropropionate
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 251.071306393 u
Formula C13H14ClNO2
InChI InChI=1S/C10H9N.C3H5ClO2/c11-10-7-3-5-8-4-1-2-6-9(8)10;1-2(4)3(5)6/h1-7H,11H2;2H,1H3,(H,5,6)
InChIKey TWNCTWABIARSJY-UHFFFAOYSA-N
Molecular Weight 251.713 g/mol
Nominal Mass 251 u
SMILES OC(C(C)Cl)=O.NC1=CC=CC=2C=CC=CC12
Spectrum/Structure Validation Score (Raman) 0.938009