CID 384626

Nsc674640

Structural Information

Molecular Formula
C19H15F5N2O
SMILES
C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)CCNC(=O)C(C(F)(F)F)(F)F
InChI
InChI=1S/C19H15F5N2O/c20-18(21,19(22,23)24)17(27)25-11-10-14-13-8-4-5-9-15(13)26-16(14)12-6-2-1-3-7-12/h1-9,26H,10-11H2,(H,25,27)
InChIKey
CYAMJBSWFUADHP-UHFFFAOYSA-N
Compound name
2,2,3,3,3-pentafluoro-N-[2-(2-phenyl-1H-indol-3-yl)ethyl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

382.11044 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.11772 184.5
[M+Na]+ 405.09966 192.9
[M-H]- 381.10316 183.4
[M+NH4]+ 400.14426 196.5
[M+K]+ 421.07360 185.3
[M+H-H2O]+ 365.10770 172.6
[M+HCOO]- 427.10864 198.1
[M+CH3COO]- 441.12429 216.7
[M+Na-2H]- 403.08511 187.6
[M]+ 382.10989 178.5
[M]- 382.11099 178.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.