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1-Tyrosine, benzyl ester, hydrochloride
SpectraBase Compound ID FgcYUySkfJy
InChI InChI=1S/C16H17NO3.ClH/c17-15(10-12-6-8-14(18)9-7-12)16(19)20-11-13-4-2-1-3-5-13;/h1-9,15,18H,10-11,17H2;1H
InChIKey TWUDEFNJKBQTMK-UHFFFAOYSA-N
Mol Weight 307.78 g/mol
Molecular Formula C16H18ClNO3
Exact Mass 307.097521 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 16bw0jchabc
Name 1-Tyrosine, benzyl ester, hydrochloride
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 307.097521141 u
Formula C16H18ClNO3
InChI InChI=1S/C16H17NO3.ClH/c17-15(10-12-6-8-14(18)9-7-12)16(19)20-11-13-4-2-1-3-5-13;/h1-9,15,18H,10-11,17H2;1H
InChIKey TWUDEFNJKBQTMK-UHFFFAOYSA-N
SMILES Cl.OC1=CC=C(CC(C(OCC=2C=CC=CC2)=O)N)C=C1
Spectrum/Structure Validation Score (Raman) 0.885967