CID 3040462

K 8146

Structural Information

Molecular Formula
C24H28N2O2
SMILES
C1CCN(CC1)CC2=C(OC3=C(C2=O)C4=CC=CC=C4C=C3)N5CCCCC5
InChI
InChI=1S/C24H28N2O2/c27-23-20(17-25-13-5-1-6-14-25)24(26-15-7-2-8-16-26)28-21-12-11-18-9-3-4-10-19(18)22(21)23/h3-4,9-12H,1-2,5-8,13-17H2
InChIKey
LIFUODPNHGMYKD-UHFFFAOYSA-N
Compound name
3-piperidin-1-yl-2-(piperidin-1-ylmethyl)benzo[f]chromen-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

376.2151 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 377.22238 193.5
[M+Na]+ 399.20432 210.2
[M+NH4]+ 394.24892 202.7
[M+K]+ 415.17826 199.9
[M-H]- 375.20782 202.2
[M+Na-2H]- 397.18977 201.3
[M]+ 376.21455 198.6
[M]- 376.21565 198.6
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.