CID 71302323

2-(difluoromethoxy)pyridin-4-amine

Structural Information

Molecular Formula
C6H6F2N2O
SMILES
C1=CN=C(C=C1N)OC(F)F
InChI
InChI=1S/C6H6F2N2O/c7-6(8)11-5-3-4(9)1-2-10-5/h1-3,6H,(H2,9,10)
InChIKey
ANSJJZVEYXIANC-UHFFFAOYSA-N
Compound name
2-(difluoromethoxy)pyridin-4-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

160.04482 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.05210 127.3
[M+Na]+ 183.03404 135.9
[M-H]- 159.03754 126.9
[M+NH4]+ 178.07864 146.3
[M+K]+ 199.00798 134.3
[M+H-H2O]+ 143.04208 119.1
[M+HCOO]- 205.04302 149.1
[M+CH3COO]- 219.05867 178.5
[M+Na-2H]- 181.01949 133.3
[M]+ 160.04427 123.8
[M]- 160.04537 123.8
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

patents stripe