CID 64989471

1286743-83-6

Structural Information

Molecular Formula

SMILES

CNCCOC(F)(F)F

InChI

InChI=1S/C4H8F3NO/c1-8-2-3-9-4(5,6)7/h8H,2-3H2,1H3

InChIKey

VHELLJPSLBTBKY-UHFFFAOYSA-N

Compound name

N-methyl-2-(trifluoromethoxy)ethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 143.0558 Da
Monoisotopic Mass: 0.9
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]+	144.063076	124.0
[M+Na]+	166.045018	131.7
[M-H]-	142.048524	120.6
[M+NH4]+	161.089623	145.3
[M+K]+	182.018958	131.6
[M+H-H2O]+	126.053060	117.1
[M+HCOO]-	188.054001	145.0
[M+CH3COO]-	202.069651	175.9
[M+Na-2H]-	164.030466	131.2
[M]+	143.05525142	120.8
[M]-	143.05634858	120.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe