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CHEBI:16804 - (RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline

ChEBI IDCHEBI:16804
ChEBI Name(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline
Stars
ASCII Name(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline
Secondary ChEBI IDsCHEBI:363, CHEBI:364, CHEBI:11019, CHEBI:18716, CHEBI:28730
Last Modified23 October 2015
DownloadsMolfile
FormulaC16H17N
Net Charge0
Average Mass223.319
Monoisotopic Mass223.13610
SMILESc1ccc(CC2NCCc3ccccc32)cc1
InChIInChI=1S/C16H17N/c1-2-6-13(7-3-1)12-16-15-9-5-4-8-14(15)10-11-17-16/h1-9,16-17H,10-12H2
InChIKeyYRYCIFUZSUMAAY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:16804) is a benzyltetrahydroisoquinoline (CHEBI:26901)
(RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:16804) is conjugate base of 1-benzyl-1,2,3,4-tetrahydroisoquinolin-2-ium (CHEBI:57902)
Incoming Relation(s)
1-benzyl-1,2,3,4-tetrahydroisoquinolin-2-ium (CHEBI:57902) is conjugate acid of (RS)-1-benzyl-1,2,3,4-tetrahydroisoquinoline (CHEBI:16804)
IUPAC Name 
rac-(1R)-1-benzyl-1,2,3,4-tetrahydroisoquinoline
Synonyms  Source
(R,S)-TetrahydrobenzylisoquinolineKEGG COMPOUND
(RS)-1-Benzyl-1,2,3,4-tetrahydroisoquinolineKEGG COMPOUND
1,2,3,4-Tetrahydro-1-(phenylmethyl)isoquinolineChemIDplus
1BnTIQChemIDplus
Manual XrefsDatabases
C05201KEGG COMPOUND
Registry NumbersSources
CAS:19716-56-4ChemIDplus