CID 21916227

(cyclopropylmethyl)(2,2,2-trifluoroethyl)amine hydrochloride

Structural Information

Molecular Formula
C6H10F3N
SMILES
C1CC1CNCC(F)(F)F
InChI
InChI=1S/C6H10F3N/c7-6(8,9)4-10-3-5-1-2-5/h5,10H,1-4H2
InChIKey
WIXVHLQTPNUBTC-UHFFFAOYSA-N
Compound name
N-(cyclopropylmethyl)-2,2,2-trifluoroethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

153.07654 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.083816 123.0
[M+Na]+ 176.065758 131.7
[M-H]- 152.069264 123.8
[M+NH4]+ 171.110363 139.0
[M+K]+ 192.039698 129.3
[M+H-H2O]+ 136.073800 114.9
[M+HCOO]- 198.074741 143.7
[M+CH3COO]- 212.090391 181.8
[M+Na-2H]- 174.051206 130.1
[M]+ 153.07599142 120.6
[M]- 153.07708858 120.6
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

patents stripe