CID 132349254

2137617-61-7

Structural Information

Molecular Formula
C8H10F3N3
SMILES
C1C(CC2=C(C1C(F)(F)F)C=NN2)N
InChI
InChI=1S/C8H10F3N3/c9-8(10,11)6-1-4(12)2-7-5(6)3-13-14-7/h3-4,6H,1-2,12H2,(H,13,14)
InChIKey
NYGXCMYDQWYVCJ-UHFFFAOYSA-N
Compound name
4-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

205.08269 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.089966 140.8
[M+Na]+ 228.071908 149.3
[M-H]- 204.075414 137.0
[M+NH4]+ 223.116513 159.0
[M+K]+ 244.045848 145.0
[M+H-H2O]+ 188.079950 132.0
[M+HCOO]- 250.080891 155.0
[M+CH3COO]- 264.096541 183.6
[M+Na-2H]- 226.057356 144.7
[M]+ 205.08214142 131.3
[M]- 205.08323858 131.3
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