CID 14545

N,n-bis(2-fluoroethyl)aniline hydrochloride

Structural Information

Molecular Formula

C₁₀H₁₃F₂N

SMILES

C1=CC=C(C=C1)N(CCF)CCF

InChI

InChI=1S/C10H13F2N/c11-6-8-13(9-7-12)10-4-2-1-3-5-10/h1-5H,6-9H2

InChIKey

VTVNWWIMWDBJTE-UHFFFAOYSA-N

Compound name

N,N-bis(2-fluoroethyl)aniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 185.10161 Da
Monoisotopic Mass: 2.4
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]+	186.10889	140.4
[M+Na]+	208.09083	150.9
[M+NH4]+	203.13543	148.3
[M+K]+	224.06477	143.7
[M-H]-	184.09433	141.1
[M+Na-2H]-	206.07628	147.0
[M]+	185.10106	141.9
[M]-	185.10216	141.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe