CID 46835542

2,2,2-trifluoro-1-(1h-indol-7-yl)ethanol

Structural Information

Molecular Formula
C10H8F3NO
SMILES
C1=CC2=C(C(=C1)C(C(F)(F)F)O)NC=C2
InChI
InChI=1S/C10H8F3NO/c11-10(12,13)9(15)7-3-1-2-6-4-5-14-8(6)7/h1-5,9,14-15H
InChIKey
OCSJDSSFVBWSFW-UHFFFAOYSA-N
Compound name
2,2,2-trifluoro-1-(1H-indol-7-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.0558 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.06308 144.6
[M+Na]+ 238.04502 153.4
[M+NH4]+ 233.08962 150.2
[M+K]+ 254.01896 150.5
[M-H]- 214.04852 140.5
[M+Na-2H]- 236.03047 148.0
[M]+ 215.05525 144.3
[M]- 215.05635 144.3
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

No patent data available for this compound.