CID 10474335

Pb-28

Structural Information

Molecular Formula
C24H38N2O
SMILES
COC1=CC=CC2=C1CCCC2CCCN3CCN(CC3)C4CCCCC4
InChI
InChI=1S/C24H38N2O/c1-27-24-14-6-12-22-20(8-5-13-23(22)24)9-7-15-25-16-18-26(19-17-25)21-10-3-2-4-11-21/h6,12,14,20-21H,2-5,7-11,13,15-19H2,1H3
InChIKey
PHRCDWVPTULQMT-UHFFFAOYSA-N
Compound name
1-cyclohexyl-4-[3-(5-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)propyl]piperazine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

47
References

49
Patents

370.2984 Da
Monoisotopic Mass

5.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 371.30568 198.8
[M+Na]+ 393.28762 210.4
[M+NH4]+ 388.33222 207.5
[M+K]+ 409.26156 200.4
[M-H]- 369.29112 204.9
[M+Na-2H]- 391.27307 203.9
[M]+ 370.29785 202.1
[M]- 370.29895 202.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe