CID 165755559

2-chloro-3-(2-chloro-1,1,2-trifluoroethoxy)pyridine

Structural Information

Molecular Formula
C7H4Cl2F3NO
SMILES
C1=CC(=C(N=C1)Cl)OC(C(F)Cl)(F)F
InChI
InChI=1S/C7H4Cl2F3NO/c8-5-4(2-1-3-13-5)14-7(11,12)6(9)10/h1-3,6H
InChIKey
JAMZMGNKYGJOGS-UHFFFAOYSA-N
Compound name
2-chloro-3-(2-chloro-1,1,2-trifluoroethoxy)pyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.9622 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.96948 138.1
[M+Na]+ 267.95142 148.5
[M-H]- 243.95492 136.1
[M+NH4]+ 262.99602 155.4
[M+K]+ 283.92536 143.7
[M+H-H2O]+ 227.95946 130.8
[M+HCOO]- 289.96040 146.9
[M+CH3COO]- 303.97605 189.0
[M+Na-2H]- 265.93687 143.4
[M]+ 244.96165 138.1
[M]- 244.96275 138.1
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

No patent data available for this compound.