CID 15657

N-cyclohexylbenzamide

Structural Information

Molecular Formula
C13H17NO
SMILES
C1CCC(CC1)NC(=O)C2=CC=CC=C2
InChI
InChI=1S/C13H17NO/c15-13(11-7-3-1-4-8-11)14-12-9-5-2-6-10-12/h1,3-4,7-8,12H,2,5-6,9-10H2,(H,14,15)
InChIKey
KQJYDHWNYPRIRY-UHFFFAOYSA-N
Compound name
N-cyclohexylbenzamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

425
Patents

203.13101 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.138286 146.1
[M+Na]+ 226.120228 149.2
[M-H]- 202.123734 151.5
[M+NH4]+ 221.164833 164.0
[M+K]+ 242.094168 146.5
[M+H-H2O]+ 186.128270 138.7
[M+HCOO]- 248.129211 167.0
[M+CH3COO]- 262.144861 186.3
[M+Na-2H]- 224.105676 150.8
[M]+ 203.13046142 139.8
[M]- 203.13155858 139.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe