CID 365110

Nsc632173

Structural Information

Molecular Formula
C23H22N4O3
SMILES
CN(C)C1=CC2=C(C=C1)C(=CC=C3C(=O)NC(=O)NC3=O)C4=C2C=C(C=C4)N(C)C
InChI
InChI=1S/C23H22N4O3/c1-26(2)13-5-7-16-15(9-10-18-21(28)24-23(30)25-22(18)29)17-8-6-14(27(3)4)12-20(17)19(16)11-13/h5-12H,1-4H3,(H2,24,25,28,29,30)
InChIKey
JFQXVGSTIPSONS-UHFFFAOYSA-N
Compound name
5-[2-[3,6-bis(dimethylamino)fluoren-9-ylidene]ethylidene]-1,3-diazinane-2,4,6-trione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

402.1692 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 403.17648 197.5
[M+Na]+ 425.15842 204.4
[M-H]- 401.16192 203.4
[M+NH4]+ 420.20302 208.9
[M+K]+ 441.13236 198.0
[M+H-H2O]+ 385.16646 188.4
[M+HCOO]- 447.16740 213.2
[M+CH3COO]- 461.18305 232.7
[M+Na-2H]- 423.14387 195.5
[M]+ 402.16865 195.5
[M]- 402.16975 195.5
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.