CID 679480

4-amino-n-cyclohexylbenzamide

Structural Information

Molecular Formula

C₁₃H₁₈N₂O

SMILES

C1CCC(CC1)NC(=O)C2=CC=C(C=C2)N

InChI

InChI=1S/C13H18N2O/c14-11-8-6-10(7-9-11)13(16)15-12-4-2-1-3-5-12/h6-9,12H,1-5,14H2,(H,15,16)

InChIKey

KAESCVXWIWIQKP-UHFFFAOYSA-N

Compound name

4-amino-N-cyclohexylbenzamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 48
Patents: 218.1419 Da
Monoisotopic Mass: 2.3
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]+	219.14918	151.5
[M+Na]+	241.13112	161.6
[M+NH4]+	236.17572	160.0
[M+K]+	257.10506	155.1
[M-H]-	217.13462	156.4
[M+Na-2H]-	239.11657	158.5
[M]+	218.14135	154.0
[M]-	218.14245	154.0

Literature stripe

literature stripe

Patent stripe

patents stripe