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2-(2-Phenylethyl)aspartic acid hydrochloride

View entire compound with spectra: 1 MS (GC)

2-(2-Phenylethyl)aspartic acid hydrochloride
SpectraBase Compound ID InG1PBILDT5
InChI InChI=1S/C12H15NO4.Cl/c13-12(11(16)17,8-10(14)15)7-6-9-4-2-1-3-5-9;/h1-5H,6-8,13H2,(H,14,15)(H,16,17);/t12-;/m0./s1
InChIKey GONJCAAEDMEANA-YDALLXLXSA-N
Mol Weight 272.71 g/mol
Molecular Formula C12H15ClNO4
Exact Mass 272.068961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5Hkrg5exSj6
Name 2-(2-Phenylethyl)aspartic acid hydrochloride
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16ClNO4
InChI InChI=1S/C12H15NO4.Cl/c13-12(11(16)17,8-10(14)15)7-6-9-4-2-1-3-5-9;/h1-5H,6-8,13H2,(H,14,15)(H,16,17);/t12-;/m0./s1
InChIKey GONJCAAEDMEANA-YDALLXLXSA-N
Molecular Weight 273.716 g/mol
SMILES Cl.OC(C[C@](C(=O)O)(CCc1ccccc1)N)=O
SPLASH splash10-0006-8910000000-a31f43c4b848c640df63
Source of Spectrum F-52-8379-15
Wiley ID 797134