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CAS Number: 95882-33-0
3-cyclopentyl-3-oxopropanenitrile

Structure

3-cyclopentyl-3-oxopropanenitrile
Name: 3-cyclopentyl-3-oxopropanenitrile
Synonyms:
General Information
Product Number: 95882330
CAS Registry Number: 95882-33-0
Name:
        Cyclopentanepropanen​itrile, β-​oxo-
        3-​Cyclopentyl-​3-​oxopropanenitrile; 3-​Cyclopentyl-​3-​oxopropionitrile; β-​Oxocyclopentanepropa​nenitrile 
 
Chemical Formula: C8H11NO
Exact Mass: 137.08
Molecular Weight: 137.18
m/z: 137.08 (100.0%), 138.09 (8.8%)
Elemental Analysis: C, 70.04; H, 8.08; N, 10.21; O, 11.66
 
InChI: InChI=1S/C8H11NO/c9-6-5-8(10)7-3-1-2-4-7/h7H,1-5H2
InChIKey: FOCJXECLIBAZSA-UHFFFAOYSA-N
Canonical SMILES : C1CCC(C1)C(=O)CC#N

Specification

98%

References

PCT Int. Appl. (2014), WO 2014029723 A1 20140227. 

PCT Int. Appl. (2013), WO 2013174931 A1 20131128. 

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