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CAS Number: 109346-98-7
3-(2-oxoethyl)benzonitrile

Structure

3-(2-oxoethyl)benzonitrile
Name: 3-(2-oxoethyl)benzonitrile
Synonyms:
General Information
Product Number: 109346987

CAS Registry Number 109346-98-7
Name:
Benzonitrile, 3-​(2-​oxoethyl)​-
3-(Formylmethyl)benzonitrile

 

Chemical Formula: C9H7NO
Exact Mass: 145.05
Molecular Weight: 145.16
m/z: 145.05 (100.0%), 146.06 (9.9%)

 

InChI:InChI=1S/C9H7NO/c10-7-9-3-1-2-8(6-9)4-5-11/h1-3,5-6H,4H2

InChI Key:ADLIBSBJYAKITA-UHFFFAOYSA-N

Canonical SMILES:C1=CC(=CC(=C1)CC=O)C#N

Specification

98%

References

PCT Int. Appl. (2012), WO 2012058134 A1 20120503.

PCT Int. Appl. (2012), WO 2012002680 A2 20120105.                                 

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