| CAS Number: 138165-77-2 (S)-3-amino-4-phenylbutanoic acid hydrochloride |
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| General Information | ||||||
| Product Number: 138165772
CAS Registry Number: 138165-77-2
(Component: 26250-87-3)
Name:
Benzenebutanoic acid, β-amino-, hydrochloride (1:1), (βS)-
Benzenebutanoic acid, β-amino-, hydrochloride, (S)-; Benzenebutanoic acid, β-amino-, hydrochloride, (βS)- (9CI); (S)-3-Amino-4-phenylbutyric acid hydrochloride; (S)-β-Aminobenzenebutanoic acid hydrochloride
Chemical Formula: C10H14ClNO2
Exact Mass: 215.07
Molecular Weight: 215.68
m/z: 215.07 (100.0%), 217.07 (32.0%), 216.07 (11.2%), 218.07 (3.7%)
Elemental Analysis: C, 55.69; H, 6.54; Cl, 16.44; N, 6.49; O, 14.84
InChI: InChI=1S/C10H13NO2.ClH/c11-9(7-10(12)13)6-8-4-2-1-3-5-8;/h1-5,9H,6-7,11H2,(H,12,13);1H/t9-;/m0./s1
InChIKey: MQTMGKGSJOPWJW-FVGYRXGTSA-N
Canonical SMILES : C1=CC=C(C=C1)CC(CC(=O)O)N.Cl
Isomeric SMILES: C1=CC=C(C=C1)C[C@@H](CC(=O)O)N.Cl
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Specification |
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98% |
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