CID 26410

N-cyclohexyl-4-(2-cyclohexylaminoacetylamino)salicylamide, hydrochloride

Structural Information

Molecular Formula
C21H31N3O3
SMILES
C1CCC(CC1)NCC(=O)NC2=CC(=C(C=C2)C(=O)NC3CCCCC3)O
InChI
InChI=1S/C21H31N3O3/c25-19-13-17(23-20(26)14-22-15-7-3-1-4-8-15)11-12-18(19)21(27)24-16-9-5-2-6-10-16/h11-13,15-16,22,25H,1-10,14H2,(H,23,26)(H,24,27)
InChIKey
JIOGWROVTNEBDY-UHFFFAOYSA-N
Compound name
N-cyclohexyl-4-[[2-(cyclohexylamino)acetyl]amino]-2-hydroxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

373.23654 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.24382 187.6
[M+Na]+ 396.22576 184.9
[M-H]- 372.22926 193.0
[M+NH4]+ 391.27036 196.5
[M+K]+ 412.19970 181.3
[M+H-H2O]+ 356.23380 177.9
[M+HCOO]- 418.23474 202.8
[M+CH3COO]- 432.25039 221.9
[M+Na-2H]- 394.21121 186.3
[M]+ 373.23599 176.4
[M]- 373.23709 176.4
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

No patent data available for this compound.