CID 14974987

N-[2-(4-fluorophenyl)-1,1-dimethylethyl]formamide

Structural Information

Molecular Formula

C₁₁H₁₄FNO

SMILES

CC(C)(CC1=CC=C(C=C1)F)NC=O

InChI

InChI=1S/C11H14FNO/c1-11(2,13-8-14)7-9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3,(H,13,14)

InChIKey

GDEDYHLMZWVVBL-UHFFFAOYSA-N

Compound name

N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]formamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 12
Patents: 195.10594 Da
Monoisotopic Mass: 2.2
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]+	196.113216	141.6
[M+Na]+	218.095158	149.0
[M-H]-	194.098664	144.0
[M+NH4]+	213.139763	161.0
[M+K]+	234.069098	146.4
[M+H-H2O]+	178.103200	135.0
[M+HCOO]-	240.104141	164.3
[M+CH3COO]-	254.119791	187.5
[M+Na-2H]-	216.080606	148.4
[M]+	195.10539142	141.0
[M]-	195.10648858	141.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe