CID 34116

28028-10-6

Structural Information

Molecular Formula
C26H36N4O
SMILES
CC1(C2=CC=CC=C2N(C3=CC=CC=C31)CCCN4CCC(CC4)(C(=O)N)N(C)C)C
InChI
InChI=1S/C26H36N4O/c1-25(2)20-10-5-7-12-22(20)30(23-13-8-6-11-21(23)25)17-9-16-29-18-14-26(15-19-29,24(27)31)28(3)4/h5-8,10-13H,9,14-19H2,1-4H3,(H2,27,31)
InChIKey
OTOUAUVLSFUURF-UHFFFAOYSA-N
Compound name
1-[3-(9,9-dimethylacridin-10-yl)propyl]-4-(dimethylamino)piperidine-4-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

420.2889 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.29618 206.4
[M+Na]+ 443.27812 210.3
[M-H]- 419.28162 211.0
[M+NH4]+ 438.32272 219.1
[M+K]+ 459.25206 205.2
[M+H-H2O]+ 403.28616 194.6
[M+HCOO]- 465.28710 218.6
[M+CH3COO]- 479.30275 212.9
[M+Na-2H]- 441.26357 207.8
[M]+ 420.28835 203.3
[M]- 420.28945 203.3
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.