CID 80647585

6-(2,2,2-trifluoroethoxy)pyrazin-2-amine

Structural Information

Molecular Formula
C6H6F3N3O
SMILES
C1=C(N=C(C=N1)OCC(F)(F)F)N
InChI
InChI=1S/C6H6F3N3O/c7-6(8,9)3-13-5-2-11-1-4(10)12-5/h1-2H,3H2,(H2,10,12)
InChIKey
UDXNBGXOAPVQTH-UHFFFAOYSA-N
Compound name
6-(2,2,2-trifluoroethoxy)pyrazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

193.0463 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.053576 135.2
[M+Na]+ 216.035518 144.6
[M-H]- 192.039024 132.2
[M+NH4]+ 211.080123 151.6
[M+K]+ 232.009458 142.2
[M+H-H2O]+ 176.043560 125.6
[M+HCOO]- 238.044501 153.9
[M+CH3COO]- 252.060151 182.9
[M+Na-2H]- 214.020966 142.5
[M]+ 193.04575142 131.0
[M]- 193.04684858 131.0
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