CID 16244445

4-(trifluoromethyl)indoline hydrochloride

Structural Information

Molecular Formula
C9H8F3N
SMILES
C1CNC2=CC=CC(=C21)C(F)(F)F
InChI
InChI=1S/C9H8F3N/c10-9(11,12)7-2-1-3-8-6(7)4-5-13-8/h1-3,13H,4-5H2
InChIKey
FOCIDGZBJANSEG-UHFFFAOYSA-N
Compound name
4-(trifluoromethyl)-2,3-dihydro-1H-indole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

187.06088 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.06816 140.6
[M+Na]+ 210.05010 149.2
[M+NH4]+ 205.09470 147.2
[M+K]+ 226.02404 145.3
[M-H]- 186.05360 137.3
[M+Na-2H]- 208.03555 143.9
[M]+ 187.06033 140.6
[M]- 187.06143 140.6
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