CID 95053

N,n-dicyclohexylbenzamide

Structural Information

Molecular Formula
C19H27NO
SMILES
C1CCC(CC1)N(C2CCCCC2)C(=O)C3=CC=CC=C3
InChI
InChI=1S/C19H27NO/c21-19(16-10-4-1-5-11-16)20(17-12-6-2-7-13-17)18-14-8-3-9-15-18/h1,4-5,10-11,17-18H,2-3,6-9,12-15H2
InChIKey
QJUBWCXHSCFIHV-UHFFFAOYSA-N
Compound name
N,N-dicyclohexylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

102
Patents

285.20926 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.21654 170.2
[M+Na]+ 308.19848 168.8
[M-H]- 284.20198 178.1
[M+NH4]+ 303.24308 184.3
[M+K]+ 324.17242 166.0
[M+H-H2O]+ 268.20652 160.5
[M+HCOO]- 330.20746 186.3
[M+CH3COO]- 344.22311 204.8
[M+Na-2H]- 306.18393 170.2
[M]+ 285.20871 160.1
[M]- 285.20981 160.1
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