CID 3067676

Brn 4577665

Structural Information

Molecular Formula
C24H30N2O2
SMILES
C1CC2=CC=CC=C2OC1CN3CCN(CC3)CC4CCC5=CC=CC=C5O4
InChI
InChI=1S/C24H30N2O2/c1-3-7-23-19(5-1)9-11-21(27-23)17-25-13-15-26(16-14-25)18-22-12-10-20-6-2-4-8-24(20)28-22/h1-8,21-22H,9-18H2
InChIKey
GDLNOLCWUGOEQI-UHFFFAOYSA-N
Compound name
1,4-bis(3,4-dihydro-2H-chromen-2-ylmethyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

378.23074 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 379.23802 196.9
[M+Na]+ 401.21996 211.7
[M+NH4]+ 396.26456 206.0
[M+K]+ 417.19390 202.0
[M-H]- 377.22346 206.5
[M+Na-2H]- 399.20541 202.5
[M]+ 378.23019 201.9
[M]- 378.23129 201.9
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.