CID 132354620

1-(2,2-dimethylcyclopropyl)-2,2,2-trifluoroethan-1-amine hydrochloride

Structural Information

Molecular Formula
C7H12F3N
SMILES
CC1(CC1C(C(F)(F)F)N)C
InChI
InChI=1S/C7H12F3N/c1-6(2)3-4(6)5(11)7(8,9)10/h4-5H,3,11H2,1-2H3
InChIKey
RXWQHDXXCVZOTO-UHFFFAOYSA-N
Compound name
1-(2,2-dimethylcyclopropyl)-2,2,2-trifluoroethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.09218 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.099456 126.2
[M+Na]+ 190.081398 135.8
[M-H]- 166.084904 127.1
[M+NH4]+ 185.126003 143.6
[M+K]+ 206.055338 134.0
[M+H-H2O]+ 150.089440 119.8
[M+HCOO]- 212.090381 144.6
[M+CH3COO]- 226.106031 185.4
[M+Na-2H]- 188.066846 131.2
[M]+ 167.09163142 123.4
[M]- 167.09272858 123.4
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.