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CAS Number: 79960-43-3
9H-pyrido[3,4-b]indole-1-carbonitrile

Structure

 9H-pyrido[3,4-b]indole-1-carbonitrile
Name: 9H-pyrido[3,4-b]indole-1-carbonitrile
Synonyms:
General Information
Product Number: 79960433

CAS Registry Number 79960-43-3
Name:
9H-?Pyrido[3,?4-?b]?indole-?1-?carbonitrile
β-Carboline-1-carbonitrile

 

Chemical Formula: C12H7N3
Exact Mass: 193.06
Molecular Weight: 193.20
m/z: 193.06 (100.0%), 194.07 (13.1%), 194.06 (1.1%)

 

InChI:InChI=1S/C12H7N3/c13-7-11-12-9(5-6-14-11)8-3-1-2-4-10(8)15-12/h1-6,15H

InChI Key:WKTIQIMSHWNROR-UHFFFAOYSA-N

Canonical SMILES:C1=CC=C2C(=C1)C3=C(N2)C(=NC=C3)C#N

 

Thermal Properties Value Condition Note
Melting Point 231-232 °C   (1)IC

Specification

98%
References
  1. (1) Veeraraghavan, Seshadri; Journal of Heterocyclic Chemistry 1981, V18(5), P909-15 CAPLUS
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