CID 29004768

2-chloro-6-(2,2,3,3-tetrafluoropropoxy)pyrazine

Structural Information

Molecular Formula
C7H5ClF4N2O
SMILES
C1=C(N=C(C=N1)Cl)OCC(C(F)F)(F)F
InChI
InChI=1S/C7H5ClF4N2O/c8-4-1-13-2-5(14-4)15-3-7(11,12)6(9)10/h1-2,6H,3H2
InChIKey
FFSYCDLXLWQBFE-UHFFFAOYSA-N
Compound name
2-chloro-6-(2,2,3,3-tetrafluoropropoxy)pyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.00266 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.00994 140.7
[M+Na]+ 266.99188 150.9
[M-H]- 242.99538 136.5
[M+NH4]+ 262.03648 156.2
[M+K]+ 282.96582 146.8
[M+H-H2O]+ 226.99992 130.7
[M+HCOO]- 289.00086 152.0
[M+CH3COO]- 303.01651 189.9
[M+Na-2H]- 264.97733 146.1
[M]+ 244.00211 138.8
[M]- 244.00321 138.8
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.