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CAS Number: 6952-13-2
2-(5-nitro-1H-indol-3-yl)acetonitrile

Structure

 2-(5-nitro-1H-indol-3-yl)acetonitrile
Name: 2-(5-nitro-1H-indol-3-yl)acetonitrile
Synonyms:
General Information
Product Number: 6952132

CAS Registry Number 6952-13-2
Name:
1H-?Indole-?3-?acetonitrile, 5-?nitro-
Indole-3-acetonitrile, 5-nitro- (6CI,7CI)
(5-Nitro-1H-indol-3-yl)acetonitrile
5-Nitro-3-indoleacetonitrile
NSC 63021

 

Chemical Formula: C10H7N3O2
Exact Mass: 201.05
Molecular Weight: 201.18
m/z: 201.05 (100.0%), 202.06 (11.0%), 202.05 (1.1%)

 

InChI:InChI=1S/C10H7N3O2/c11-4-3-7-6-12-10-2-1-8(13(14)15)5-9(7)10/h1-2,5-6,12H,3H2

InChI Key:BAYBZUUQTBZGPJ-UHFFFAOYSA-N

Canonical SMILES:C1=CC2=C(C=C1[N+](=O)[O-])C(=CN2)CC#N

Specification

98%
References
  1. (1) Cavallini, G.; Farmaco, Edizione Scientifica 1958, V13, P105-12 CAPLUS
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