CID 479383

2,8-bis(4-methyl1-piperazinylmethyl)phenazine

Structural Information

Molecular Formula
C24H32N6
SMILES
CN1CCN(CC1)CC2=CC3=C(C=C2)N=C4C=CC(=CC4=N3)CN5CCN(CC5)C
InChI
InChI=1S/C24H32N6/c1-27-7-11-29(12-8-27)17-19-3-5-21-23(15-19)26-24-16-20(4-6-22(24)25-21)18-30-13-9-28(2)10-14-30/h3-6,15-16H,7-14,17-18H2,1-2H3
InChIKey
MZBSORTVVGDWJE-UHFFFAOYSA-N
Compound name
2,8-bis[(4-methylpiperazin-1-yl)methyl]phenazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

404.26886 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 405.27614 209.4
[M+Na]+ 427.25808 214.7
[M-H]- 403.26158 210.5
[M+NH4]+ 422.30268 212.8
[M+K]+ 443.23202 205.0
[M+H-H2O]+ 387.26612 193.2
[M+HCOO]- 449.26706 214.7
[M+CH3COO]- 463.28271 213.6
[M+Na-2H]- 425.24353 210.6
[M]+ 404.26831 203.5
[M]- 404.26941 203.5
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

No patent data available for this compound.