CID 1527154

N-methyl-m-(trifluoromethyl)cinnamamide

Structural Information

Molecular Formula
C11H10F3NO
SMILES
CNC(=O)/C=C/C1=CC(=CC=C1)C(F)(F)F
InChI
InChI=1S/C11H10F3NO/c1-15-10(16)6-5-8-3-2-4-9(7-8)11(12,13)14/h2-7H,1H3,(H,15,16)/b6-5+
InChIKey
YEBIYCKHVHLBHN-AATRIKPKSA-N
Compound name
(E)-N-methyl-3-[3-(trifluoromethyl)phenyl]prop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

14
Patents

229.07144 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.07872 146.5
[M+Na]+ 252.06066 154.3
[M-H]- 228.06416 146.3
[M+NH4]+ 247.10526 164.4
[M+K]+ 268.03460 150.7
[M+H-H2O]+ 212.06870 138.2
[M+HCOO]- 274.06964 166.3
[M+CH3COO]- 288.08529 191.0
[M+Na-2H]- 250.04611 150.9
[M]+ 229.07089 141.8
[M]- 229.07199 141.8
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

patents stripe