CID 11206034

3-(chloromethyl)-6-methoxy-2-methylpyridine

Structural Information

Molecular Formula
C8H10ClNO
SMILES
CC1=C(C=CC(=N1)OC)CCl
InChI
InChI=1S/C8H10ClNO/c1-6-7(5-9)3-4-8(10-6)11-2/h3-4H,5H2,1-2H3
InChIKey
SCIGCCNSUGXEIG-UHFFFAOYSA-N
Compound name
3-(chloromethyl)-6-methoxy-2-methylpyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

171.04509 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.05237 131.8
[M+Na]+ 194.03431 146.9
[M+NH4]+ 189.07891 141.1
[M+K]+ 210.00825 139.4
[M-H]- 170.03781 134.1
[M+Na-2H]- 192.01976 139.8
[M]+ 171.04454 135.0
[M]- 171.04564 135.0
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