CID 165463441

En300-784216

Structural Information

Molecular Formula
C8H11F2N3
SMILES
CN1C(=C2CC(CCC2=N1)(F)F)N
InChI
InChI=1S/C8H11F2N3/c1-13-7(11)5-4-8(9,10)3-2-6(5)12-13/h2-4,11H2,1H3
InChIKey
RCTBJTFYXWNGIW-UHFFFAOYSA-N
Compound name
5,5-difluoro-2-methyl-6,7-dihydro-4H-indazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

187.0921 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.09938 136.0
[M+Na]+ 210.08132 146.3
[M-H]- 186.08482 135.4
[M+NH4]+ 205.12592 158.0
[M+K]+ 226.05526 143.0
[M+H-H2O]+ 170.08936 128.1
[M+HCOO]- 232.09030 154.4
[M+CH3COO]- 246.10595 184.3
[M+Na-2H]- 208.06677 140.6
[M]+ 187.09155 130.8
[M]- 187.09265 130.8
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.