CID 125511550

3-fluoro-6-(pyrrolidin-1-yl)pyridazine

Structural Information

Molecular Formula
C8H10FN3
SMILES
C1CCN(C1)C2=NN=C(C=C2)F
InChI
InChI=1S/C8H10FN3/c9-7-3-4-8(11-10-7)12-5-1-2-6-12/h3-4H,1-2,5-6H2
InChIKey
ULKDDRNSVYJOMN-UHFFFAOYSA-N
Compound name
3-fluoro-6-pyrrolidin-1-ylpyridazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.08588 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.09316 133.0
[M+Na]+ 190.07510 141.1
[M-H]- 166.07860 134.1
[M+NH4]+ 185.11970 151.0
[M+K]+ 206.04904 138.6
[M+H-H2O]+ 150.08314 123.3
[M+HCOO]- 212.08408 152.3
[M+CH3COO]- 226.09973 145.5
[M+Na-2H]- 188.06055 138.2
[M]+ 167.08533 128.8
[M]- 167.08643 128.8
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.