CID 23574312

2-cyclopropyl-2-methylpropanenitrile

Structural Information

Molecular Formula
C7H11N
SMILES
CC(C)(C#N)C1CC1
InChI
InChI=1S/C7H11N/c1-7(2,5-8)6-3-4-6/h6H,3-4H2,1-2H3
InChIKey
MVOFYFBLGIYYNJ-UHFFFAOYSA-N
Compound name
2-cyclopropyl-2-methylpropanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

18
Patents

109.08915 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.09643 125.6
[M+Na]+ 132.07837 137.2
[M+NH4]+ 127.12297 131.7
[M+K]+ 148.05231 130.4
[M-H]- 108.08187 126.0
[M+Na-2H]- 130.06382 131.3
[M]+ 109.08860 127.6
[M]- 109.08970 127.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe