CID 18615674

162960-28-3

Structural Information

Molecular Formula
C9H8N2
SMILES
C1CC1(C#N)C2=CC=CC=N2
InChI
InChI=1S/C9H8N2/c10-7-9(4-5-9)8-3-1-2-6-11-8/h1-3,6H,4-5H2
InChIKey
GAEVNPHZQRROPK-UHFFFAOYSA-N
Compound name
1-pyridin-2-ylcyclopropane-1-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

144.06874 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.07602 130.0
[M+Na]+ 167.05796 146.1
[M-H]- 143.06146 137.3
[M+NH4]+ 162.10256 147.0
[M+K]+ 183.03190 139.8
[M+H-H2O]+ 127.06600 119.8
[M+HCOO]- 189.06694 151.7
[M+CH3COO]- 203.08259 144.1
[M+Na-2H]- 165.04341 140.4
[M]+ 144.06819 128.4
[M]- 144.06929 128.4
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