CHEBI:91544 - 2-aminopropanoic acid [1-(4-chlorophenyl)-2-methylpropan-2-yl] ester

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-aminopropanoic acid [1-(4-chlorophenyl)-2-methylpropan-2-yl] ester
ChEBI ID CHEBI:91544
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C13H18ClNO2
Net Charge 0
Average Mass 255.741
Monoisotopic Mass 255.10261
InChI InChI=1S/C13H18ClNO2/c1-9(15)12(16)17-13(2,3)8-10-4-6-11(14)7-5-10/h4-7,9H,8,15H2,1-3H3
InChIKey FZSPJBYOKQPKCD-UHFFFAOYSA-N
SMILES CC(C(=O)OC(C)(C)CC1=CC=C(C=C1)Cl)N
ChEBI Ontology
Outgoing 2-aminopropanoic acid [1-(4-chlorophenyl)-2-methylpropan-2-yl] ester (CHEBI:91544) is a α-amino acid ester (CHEBI:46874)
Manual Xref Database
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