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]+ 193.052706 134.8
[M+Na]+ 215.034648 152.6
[M-H]- 191.038154 142.1
[M+NH4]+ 210.079253 149.9
[M+K]+ 231.008588 144.1
[M+H-H2O]+ 175.042690 124.9
[M+HCOO]- 237.043631 152.4
[M+CH3COO]- 251.059281 198.5
[M+Na-2H]- 213.020096 141.8
[M]+ 192.04488142 135.8
[M]- 192.04597858 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.