CID 6435636

N-cyclopropyl-alpha-methyl-m-trifluoromethylcinnamamide

Structural Information

Molecular Formula
C14H14F3NO
SMILES
C/C(=C\C1=CC(=CC=C1)C(F)(F)F)/C(=O)NC2CC2
InChI
InChI=1S/C14H14F3NO/c1-9(13(19)18-12-5-6-12)7-10-3-2-4-11(8-10)14(15,16)17/h2-4,7-8,12H,5-6H2,1H3,(H,18,19)/b9-7+
InChIKey
OLBQUZGBNROCKL-VQHVLOKHSA-N
Compound name
(E)-N-cyclopropyl-2-methyl-3-[3-(trifluoromethyl)phenyl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

269.10275 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 270.11003 165.2
[M+Na]+ 292.09197 172.9
[M+NH4]+ 287.13657 170.2
[M+K]+ 308.06591 169.7
[M-H]- 268.09547 169.1
[M+Na-2H]- 290.07742 170.6
[M]+ 269.10220 167.9
[M]- 269.10330 167.9
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.