CID 2332214

377761-83-6

Structural Information

Molecular Formula
C21H17F3N2O
SMILES
C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)NC4=CC=CC(=C4)C(F)(F)F
InChI
InChI=1S/C21H17F3N2O/c22-21(23,24)13-6-5-7-14(12-13)25-20(27)19-15-8-1-3-10-17(15)26-18-11-4-2-9-16(18)19/h1,3,5-8,10,12H,2,4,9,11H2,(H,25,27)
InChIKey
XROPHILVRNCEBI-UHFFFAOYSA-N
Compound name
N-[3-(trifluoromethyl)phenyl]-1,2,3,4-tetrahydroacridine-9-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

370.1293 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.13658 185.8
[M+Na]+ 393.11852 192.4
[M-H]- 369.12202 188.0
[M+NH4]+ 388.16312 197.7
[M+K]+ 409.09246 185.2
[M+H-H2O]+ 353.12656 173.3
[M+HCOO]- 415.12750 198.3
[M+CH3COO]- 429.14315 193.7
[M+Na-2H]- 391.10397 190.2
[M]+ 370.12875 178.9
[M]- 370.12985 178.9
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.