CID 155820973

2-chloro-6-cyclopropyl-4-methylpyridine-3-carbonitrile

Structural Information

Molecular Formula
C10H9ClN2
SMILES
CC1=CC(=NC(=C1C#N)Cl)C2CC2
InChI
InChI=1S/C10H9ClN2/c1-6-4-9(7-2-3-7)13-10(11)8(6)5-12/h4,7H,2-3H2,1H3
InChIKey
BMBVACNYOJTGFM-UHFFFAOYSA-N
Compound name
2-chloro-6-cyclopropyl-4-methylpyridine-3-carbonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.04543 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.05271 134.8
[M+Na]+ 215.03465 152.6
[M-H]- 191.03815 142.1
[M+NH4]+ 210.07925 149.9
[M+K]+ 231.00859 144.1
[M+H-H2O]+ 175.04269 124.9
[M+HCOO]- 237.04363 152.4
[M+CH3COO]- 251.05928 198.5
[M+Na-2H]- 213.02010 141.8
[M]+ 192.04488 135.8
[M]- 192.04598 135.8
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

No patent data available for this compound.