CID 201731

6699-10-1

Structural Information

Molecular Formula
C26H38N2O
SMILES
CC(C)C(CCCN(C)C)(C1=CC=CC2=CC=CC=C21)C(=O)NC3CCCCC3
InChI
InChI=1S/C26H38N2O/c1-20(2)26(18-11-19-28(3)4,25(29)27-22-14-6-5-7-15-22)24-17-10-13-21-12-8-9-16-23(21)24/h8-10,12-13,16-17,20,22H,5-7,11,14-15,18-19H2,1-4H3,(H,27,29)
InChIKey
ZTPSLMYWUXBHOE-UHFFFAOYSA-N
Compound name
N-cyclohexyl-5-(dimethylamino)-2-naphthalen-1-yl-2-propan-2-ylpentanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

394.2984 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.30568 200.8
[M+Na]+ 417.28762 199.7
[M-H]- 393.29112 206.6
[M+NH4]+ 412.33222 212.0
[M+K]+ 433.26156 196.0
[M+H-H2O]+ 377.29566 191.3
[M+HCOO]- 439.29660 215.7
[M+CH3COO]- 453.31225 233.5
[M+Na-2H]- 415.27307 200.6
[M]+ 394.29785 197.4
[M]- 394.29895 197.4
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.