CID 203833

15270-39-0

Structural Information

Molecular Formula
C13H16F3N
SMILES
CC(CC1=CC(=CC=C1)C(F)(F)F)NCC=C
InChI
InChI=1S/C13H16F3N/c1-3-7-17-10(2)8-11-5-4-6-12(9-11)13(14,15)16/h3-6,9-10,17H,1,7-8H2,2H3
InChIKey
FDCJEDHALAMHTI-UHFFFAOYSA-N
Compound name
N-prop-2-enyl-1-[3-(trifluoromethyl)phenyl]propan-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.12349 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.13077 158.7
[M+Na]+ 266.11271 166.8
[M+NH4]+ 261.15731 164.1
[M+K]+ 282.08665 160.6
[M-H]- 242.11621 156.3
[M+Na-2H]- 264.09816 162.3
[M]+ 243.12294 158.8
[M]- 243.12404 158.8
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.