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CAS Number: 50916-34-2
3-propionylbenzonitrile

Structure

 3-propionylbenzonitrile
Name: 3-propionylbenzonitrile
Synonyms:
General Information
Product Number: 50916342

CAS Registry Number 50916-34-2
Name:
Benzonitrile, 3-?(1-?oxopropyl)?-
3-(1-Oxopropyl)benzonitrile
3-Propionylbenzonitrile
3'-Cyanopropiophenone

 

Chemical Formula: C10H9NO
Exact Mass: 159.07
Molecular Weight: 159.18
m/z: 159.07 (100.0%), 160.07 (11.3%)

 

InChI:InChI=1S/C10H9NO/c1-2-10(12)9-5-3-4-8(6-9)7-11/h3-6H,2H2,1H3

InChI Key:RQNDMQXNIOALFA-UHFFFAOYSA-N

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

Specification

98%
References
  1. (1) Yeung, Pui Yee; Organic Letters 2011, V13(4), P648-651 CAPLUS
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