CID 4192464

80143-70-0

Structural Information

Molecular Formula

C₁₅H₁₇FN₂

SMILES

CN(C)C1=CC=C(C=C1)CNC2=CC=C(C=C2)F

InChI

InChI=1S/C15H17FN2/c1-18(2)15-9-3-12(4-10-15)11-17-14-7-5-13(16)6-8-14/h3-10,17H,11H2,1-2H3

InChIKey

FVVRSFMHMBKUOM-UHFFFAOYSA-N

Compound name

4-[(4-fluoroanilino)methyl]-N,N-dimethylaniline

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 9
Patents: 244.13757 Da
Monoisotopic Mass: 3.6
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]+	245.14485	155.1
[M+Na]+	267.12679	161.7
[M-H]-	243.13029	161.9
[M+NH4]+	262.17139	172.6
[M+K]+	283.10073	158.3
[M+H-H2O]+	227.13483	146.1
[M+HCOO]-	289.13577	180.6
[M+CH3COO]-	303.15142	203.2
[M+Na-2H]-	265.11224	160.6
[M]+	244.13702	154.1
[M]-	244.13812	154.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe