CID 35959

N-(4-tert-butylcyclohexyl)benzamide

Structural Information

Molecular Formula
C17H25NO
SMILES
CC(C)(C)C1CCC(CC1)NC(=O)C2=CC=CC=C2
InChI
InChI=1S/C17H25NO/c1-17(2,3)14-9-11-15(12-10-14)18-16(19)13-7-5-4-6-8-13/h4-8,14-15H,9-12H2,1-3H3,(H,18,19)
InChIKey
WYGMRNJUINLKMG-UHFFFAOYSA-N
Compound name
N-(4-tert-butylcyclohexyl)benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

259.1936 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.20088 164.8
[M+Na]+ 282.18282 175.5
[M+NH4]+ 277.22742 173.2
[M+K]+ 298.15676 168.7
[M-H]- 258.18632 169.0
[M+Na-2H]- 280.16827 171.6
[M]+ 259.19305 167.5
[M]- 259.19415 167.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe