CID 117205482

3-(2,2,2-trifluoroethyl)-2,5-dihydro-1h-pyrrole hydrochloride

Structural Information

Molecular Formula
C6H8F3N
SMILES
C1C=C(CN1)CC(F)(F)F
InChI
InChI=1S/C6H8F3N/c7-6(8,9)3-5-1-2-10-4-5/h1,10H,2-4H2
InChIKey
IHPPUGZXHTYBQR-UHFFFAOYSA-N
Compound name
3-(2,2,2-trifluoroethyl)-2,5-dihydro-1H-pyrrole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

151.06088 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.06816 135.0
[M+Na]+ 174.05010 142.1
[M+NH4]+ 169.09470 140.8
[M+K]+ 190.02404 138.9
[M-H]- 150.05360 130.6
[M+Na-2H]- 172.03555 137.6
[M]+ 151.06033 134.3
[M]- 151.06143 134.3
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