SpectraBase Compound ID | 9nBaAFRvACb |
---|---|
InChI | InChI=1S/C9H11NO3.ClH/c10-8(9(12)13)5-6-1-3-7(11)4-2-6;/h1-4,8,11H,5,10H2,(H,12,13);1H/t8-;/m0./s1 |
InChIKey | JJWFIVDAMOFNPS-QRPNPIFTSA-N |
Mol Weight | 217.65 g/mol |
Molecular Formula | C9H12ClNO3 |
Exact Mass | 217.050571 g/mol |
SpectraBase Spectrum ID | GWyRXSojuib |
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Name | L-Tyrosine 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/c10-8(9(12)13)5-6-1-3-7(11)4-2-6;/h1-4,8,11H,5,10H2,(H,12,13);1H/t8-;/m0./s1 |
InChIKey | JJWFIVDAMOFNPS-QRPNPIFTSA-N |
SMILES | Cl.C([C@](CC1=CC=C(O)C=C1)(N)[H])(=O)O |
Spectrum/Structure Validation Score (Raman) | 0.967777 |