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]+ 168.09946 126.2
[M+Na]+ 190.08140 135.8
[M-H]- 166.08490 127.1
[M+NH4]+ 185.12600 143.6
[M+K]+ 206.05534 134.0
[M+H-H2O]+ 150.08944 119.8
[M+HCOO]- 212.09038 144.6
[M+CH3COO]- 226.10603 185.4
[M+Na-2H]- 188.06685 131.2
[M]+ 167.09163 123.4
[M]- 167.09273 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.