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CAS Number: 100957-76-4
1-((1H-indol-3-yl)methyl)piperidine-4-carboxylic acid

Structure

1-((1H-indol-3-yl)methyl)piperidine-4-carboxylic acid
Name: 1-((1H-indol-3-yl)methyl)piperidine-4-carboxylic acid
Synonyms:
General Information
Product Number: 100957764

CAS Registry Number 100957-76-4
Name:
4-?Piperidinecarboxylic acid, 1-?(1H-?indol-?3-?ylmethyl)?-
Isonipecotic acid, 1-(indol-3-ylmethyl)- (6CI)

 

Chemical Formula: C15H18N2O2
Exact Mass: 258.14
Molecular Weight: 258.32
m/z: 258.14 (100.0%), 259.14 (16.5%), 260.14 (1.8%)

 

InChI:InChI=1S/C15H18N2O2/c18-15(19)11-5-7-17(8-6-11)10-12-9-16-14-4-2-1-3-13(12)14/h1-4,9,11,16H,5-8,10H2,(H,18,19)

InChI Key:QNHYWDRTEHWTAR-UHFFFAOYSA-N

Canonical SMILES:C1CN(CCC1C(=O)O)CC2=CNC3=CC=CC=C32

 

Thermal Properties Value Condition Note
Melting Point 228 °C (decomp)   (1)CAS

Specification

98%

References

(1) Swain, Ansel P.; Journal of the American Chemical Society 1957, V79, P5250-3 CAPLUS

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