CID 63896437

8-methyl-3-(trifluoromethyl)-8-azabicyclo[3.2.1]octan-3-amine dihydrochloride

Structural Information

Molecular Formula
C9H15F3N2
SMILES
CN1C2CCC1CC(C2)(C(F)(F)F)N
InChI
InChI=1S/C9H15F3N2/c1-14-6-2-3-7(14)5-8(13,4-6)9(10,11)12/h6-7H,2-5,13H2,1H3
InChIKey
IUBSYSDDJKSNDV-UHFFFAOYSA-N
Compound name
8-methyl-3-(trifluoromethyl)-8-azabicyclo[3.2.1]octan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

208.11873 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 209.12601 144.3
[M+Na]+ 231.10795 152.0
[M-H]- 207.11145 141.3
[M+NH4]+ 226.15255 167.1
[M+K]+ 247.08189 149.0
[M+H-H2O]+ 191.11599 137.2
[M+HCOO]- 253.11693 157.8
[M+CH3COO]- 267.13258 187.9
[M+Na-2H]- 229.09340 148.2
[M]+ 208.11818 135.7
[M]- 208.11928 135.7
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.