CID 3039733

Brn 0435506

Structural Information

Molecular Formula
C23H37N3O
SMILES
CC1(CC(CC(N1CCC2=CC=CC=C2)(C)C)(C(=O)N)N3CCCCC3)C
InChI
InChI=1S/C23H37N3O/c1-21(2)17-23(20(24)27,25-14-9-6-10-15-25)18-22(3,4)26(21)16-13-19-11-7-5-8-12-19/h5,7-8,11-12H,6,9-10,13-18H2,1-4H3,(H2,24,27)
InChIKey
WZULONJCHUPBMM-UHFFFAOYSA-N
Compound name
2,2,6,6-tetramethyl-1-(2-phenylethyl)-4-piperidin-1-ylpiperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

371.29367 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 372.30095 193.7
[M+Na]+ 394.28289 196.6
[M-H]- 370.28639 198.4
[M+NH4]+ 389.32749 207.9
[M+K]+ 410.25683 192.4
[M+H-H2O]+ 354.29093 183.6
[M+HCOO]- 416.29187 204.9
[M+CH3COO]- 430.30752 221.0
[M+Na-2H]- 392.26834 193.1
[M]+ 371.29312 186.6
[M]- 371.29422 186.6
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.