CID 129917567

2-chloro-5-(cyclopropylmethyl)pyridine

Structural Information

Molecular Formula
C9H10ClN
SMILES
C1CC1CC2=CN=C(C=C2)Cl
InChI
InChI=1S/C9H10ClN/c10-9-4-3-8(6-11-9)5-7-1-2-7/h3-4,6-7H,1-2,5H2
InChIKey
UTORJBMFAWPHHM-UHFFFAOYSA-N
Compound name
2-chloro-5-(cyclopropylmethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

167.05017 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.057446 132.7
[M+Na]+ 190.039388 143.4
[M-H]- 166.042894 138.7
[M+NH4]+ 185.083993 148.1
[M+K]+ 206.013328 139.0
[M+H-H2O]+ 150.047430 126.0
[M+HCOO]- 212.048371 152.1
[M+CH3COO]- 226.064021 146.3
[M+Na-2H]- 188.024836 140.1
[M]+ 167.04962142 136.1
[M]- 167.05071858 136.1
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