CID 135396292

6-(trifluoromethyl)spiro[3.3]heptan-2-amine hydrochloride

Structural Information

Molecular Formula
C8H12F3N
SMILES
C1C(CC12CC(C2)N)C(F)(F)F
InChI
InChI=1S/C8H12F3N/c9-8(10,11)5-1-7(2-5)3-6(12)4-7/h5-6H,1-4,12H2
InChIKey
AMOJCEIAXDYWMT-UHFFFAOYSA-N
Compound name
6-(trifluoromethyl)spiro[3.3]heptan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.09218 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.09946 134.8
[M+Na]+ 202.08140 139.9
[M-H]- 178.08490 136.6
[M+NH4]+ 197.12600 143.4
[M+K]+ 218.05534 143.2
[M+H-H2O]+ 162.08944 120.0
[M+HCOO]- 224.09038 149.4
[M+CH3COO]- 238.10603 194.6
[M+Na-2H]- 200.06685 138.8
[M]+ 179.09163 143.6
[M]- 179.09273 143.6
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.