CID 3087258

Brn 3456223

Structural Information

Molecular Formula
C24H44N4O2
SMILES
CCCN(CCC)CCCNC1=CC(=O)C(=CC1=O)NCCCN(CCC)CCC
InChI
InChI=1S/C24H44N4O2/c1-5-13-27(14-6-2)17-9-11-25-21-19-24(30)22(20-23(21)29)26-12-10-18-28(15-7-3)16-8-4/h19-20,25-26H,5-18H2,1-4H3
InChIKey
NMTSAOSNTIQCEW-UHFFFAOYSA-N
Compound name
2,5-bis[3-(dipropylamino)propylamino]cyclohexa-2,5-diene-1,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

420.34644 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.35372 211.7
[M+Na]+ 443.33566 217.0
[M+NH4]+ 438.38026 215.8
[M+K]+ 459.30960 209.7
[M-H]- 419.33916 214.3
[M+Na-2H]- 441.32111 212.9
[M]+ 420.34589 212.6
[M]- 420.34699 212.6
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.