CID 12675262

4-(chloromethyl)-2-methylpyridine hydrochloride

Structural Information

Molecular Formula
C7H8ClN
SMILES
CC1=NC=CC(=C1)CCl
InChI
InChI=1S/C7H8ClN/c1-6-4-7(5-8)2-3-9-6/h2-4H,5H2,1H3
InChIKey
XDDLZDABUCJCMO-UHFFFAOYSA-N
Compound name
4-(chloromethyl)-2-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

298
Patents

141.03453 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 142.04181 124.5
[M+Na]+ 164.02375 139.9
[M+NH4]+ 159.06835 134.6
[M+K]+ 179.99769 131.9
[M-H]- 140.02725 127.3
[M+Na-2H]- 162.00920 133.4
[M]+ 141.03398 127.9
[M]- 141.03508 127.9
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