CID 54466132

6-cyclopropylnicotinonitrile

Structural Information

Molecular Formula
C9H8N2
SMILES
C1CC1C2=NC=C(C=C2)C#N
InChI
InChI=1S/C9H8N2/c10-5-7-1-4-9(11-6-7)8-2-3-8/h1,4,6,8H,2-3H2
InChIKey
RNXKTVGIUWBEQV-UHFFFAOYSA-N
Compound name
6-cyclopropylpyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

60
Patents

144.06874 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.07602 134.0
[M+Na]+ 167.05796 148.2
[M+NH4]+ 162.10256 140.4
[M+K]+ 183.03190 139.7
[M-H]- 143.06146 136.5
[M+Na-2H]- 165.04341 142.1
[M]+ 144.06819 137.0
[M]- 144.06929 137.0
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