CID 155370

Sd 39109

Structural Information

Molecular Formula
C15H18F3NO2
SMILES
CC(C)OC1=C(C=C(C=C1)NC(=O)C2(CC2)C)C(F)(F)F
InChI
InChI=1S/C15H18F3NO2/c1-9(2)21-12-5-4-10(8-11(12)15(16,17)18)19-13(20)14(3)6-7-14/h4-5,8-9H,6-7H2,1-3H3,(H,19,20)
InChIKey
YVYPNKBJASJHCF-UHFFFAOYSA-N
Compound name
1-methyl-N-[4-propan-2-yloxy-3-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

301.12897 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.13625 158.9
[M+Na]+ 324.11819 167.5
[M-H]- 300.12169 162.8
[M+NH4]+ 319.16279 171.2
[M+K]+ 340.09213 164.5
[M+H-H2O]+ 284.12623 150.9
[M+HCOO]- 346.12717 176.8
[M+CH3COO]- 360.14282 208.8
[M+Na-2H]- 322.10364 161.8
[M]+ 301.12842 159.6
[M]- 301.12952 159.6
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

patents stripe