CID 2736626

2-chloro-6-methyl-4-(trifluoromethyl)pyridine

Structural Information

Molecular Formula
C7H5ClF3N
SMILES
CC1=CC(=CC(=N1)Cl)C(F)(F)F
InChI
InChI=1S/C7H5ClF3N/c1-4-2-5(7(9,10)11)3-6(8)12-4/h2-3H,1H3
InChIKey
SXLBWNSGCIEART-UHFFFAOYSA-N
Compound name
2-chloro-6-methyl-4-(trifluoromethyl)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

488
Patents

195.00626 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.01354 138.0
[M+Na]+ 217.99548 149.3
[M+NH4]+ 213.04008 144.6
[M+K]+ 233.96942 143.3
[M-H]- 193.99898 135.3
[M+Na-2H]- 215.98093 143.4
[M]+ 195.00571 138.9
[M]- 195.00681 138.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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Patent stripe

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