CID 44213

Brn 1664151

Structural Information

Molecular Formula
C27H37N3O
SMILES
C1CCN(CC1)CC(CN2CCCCC2)NC(=O)C(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C27H37N3O/c31-27(26(23-13-5-1-6-14-23)24-15-7-2-8-16-24)28-25(21-29-17-9-3-10-18-29)22-30-19-11-4-12-20-30/h1-2,5-8,13-16,25-26H,3-4,9-12,17-22H2,(H,28,31)
InChIKey
KGJOPTUFIOOKOF-UHFFFAOYSA-N
Compound name
N-[1,3-di(piperidin-1-yl)propan-2-yl]-2,2-diphenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

419.29367 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 420.30095 208.3
[M+Na]+ 442.28289 218.6
[M+NH4]+ 437.32749 215.3
[M+K]+ 458.25683 210.1
[M-H]- 418.28639 215.6
[M+Na-2H]- 440.26834 216.7
[M]+ 419.29312 211.6
[M]- 419.29422 211.6
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.