CID 3057516

74051-02-8

Structural Information

Molecular Formula
C14H18F3N
SMILES
CC(CC1=CC(=CC=C1)C(F)(F)F)N(C)CC=C
InChI
InChI=1S/C14H18F3N/c1-4-8-18(3)11(2)9-12-6-5-7-13(10-12)14(15,16)17/h4-7,10-11H,1,8-9H2,2-3H3
InChIKey
COAOAYHTVVBTHV-UHFFFAOYSA-N
Compound name
N-methyl-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

257.13913 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.14641 157.9
[M+Na]+ 280.12835 164.2
[M-H]- 256.13185 158.5
[M+NH4]+ 275.17295 175.3
[M+K]+ 296.10229 161.3
[M+H-H2O]+ 240.13639 148.8
[M+HCOO]- 302.13733 176.7
[M+CH3COO]- 316.15298 203.8
[M+Na-2H]- 278.11380 159.8
[M]+ 257.13858 155.0
[M]- 257.13968 155.0
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.