CID 207919

31185-49-6

Structural Information

Molecular Formula

C₈H₁₂F₃N

SMILES

C1CCC(CC1)N=CC(F)(F)F

InChI

InChI=1S/C8H12F3N/c9-8(10,11)6-12-7-4-2-1-3-5-7/h6-7H,1-5H2

InChIKey

YNIBHQAHFSZNQB-UHFFFAOYSA-N

Compound name

N-cyclohexyl-2,2,2-trifluoroethanimine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 179.09218 Da
Monoisotopic Mass: 2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	180.09946	135.7
[M+Na]+	202.08140	141.0
[M-H]-	178.08490	135.8
[M+NH4]+	197.12600	155.8
[M+K]+	218.05534	139.4
[M+H-H2O]+	162.08944	127.5
[M+HCOO]-	224.09038	154.2
[M+CH3COO]-	238.10603	183.3
[M+Na-2H]-	200.06685	141.0
[M]+	179.09163	127.1
[M]-	179.09273	127.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe