CID 13590469

5-fluoro-2-hydrazinylpyrimidine

Structural Information

Molecular Formula
C4H5FN4
SMILES
C1=C(C=NC(=N1)NN)F
InChI
InChI=1S/C4H5FN4/c5-3-1-7-4(9-6)8-2-3/h1-2H,6H2,(H,7,8,9)
InChIKey
GBEDYDITEBFPGM-UHFFFAOYSA-N
Compound name
(5-fluoropyrimidin-2-yl)hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

45
Patents

128.04982 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 129.05710 120.5
[M+Na]+ 151.03904 129.4
[M-H]- 127.04254 120.2
[M+NH4]+ 146.08364 139.2
[M+K]+ 167.01298 127.4
[M+H-H2O]+ 111.04708 112.4
[M+HCOO]- 173.04802 144.5
[M+CH3COO]- 187.06367 174.4
[M+Na-2H]- 149.02449 129.9
[M]+ 128.04927 116.4
[M]- 128.05037 116.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe