| SpectraBase Compound ID | JmCRxTz2MMd |
|---|---|
| InChI | InChI=1S/2C9H12N2O2.2ClH.H2O/c2*10-7-3-1-6(2-4-7)5-8(11)9(12)13;;;/h2*1-4,8H,5,10-11H2,(H,12,13);2*1H;1H2/t2*8-;;;/m00.../s1 |
| InChIKey | MDTUJWLOYALSRP-VSODYHHCSA-N |
| Mol Weight | 225.676 g/mol |
| Molecular Formula | C9H13ClN2O2·½H2O |
| Exact Mass | 225.071838 g/mol |
1H Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | I93JmtcBbyC |
|---|---|
| Name | L-3-(p-aminophenyl)alanine, monohydrochloride, hemihydrate |
| Copyright | Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C9H15ClN2O3 |
| InChI | InChI=1S/2C9H12N2O2.2ClH.H2O/c2*10-7-3-1-6(2-4-7)5-8(11)9(12)13;;;/h2*1-4,8H,5,10-11H2,(H,12,13);2*1H;1H2/t2*8-;;;/m00.../s1 |
| InChIKey | MDTUJWLOYALSRP-VSODYHHCSA-N |
| Instrument Name | Varian CFT-20 |
| Sadtler NMR Number | 53408M |
| Solvent | D2O |