CID 365108

Nsc632171

Structural Information

Molecular Formula
C28H24N2O2
SMILES
CN(C)C1=CC2=C(C=C1)C(=CC=C3C(=O)C4=CC=CC=C4C3=O)C5=C2C=C(C=C5)N(C)C
InChI
InChI=1S/C28H24N2O2/c1-29(2)17-9-11-20-19(21-12-10-18(30(3)4)16-26(21)25(20)15-17)13-14-24-27(31)22-7-5-6-8-23(22)28(24)32/h5-16H,1-4H3
InChIKey
UDHRCSLXRXONRN-UHFFFAOYSA-N
Compound name
2-[2-[3,6-bis(dimethylamino)fluoren-9-ylidene]ethylidene]indene-1,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

420.18378 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 421.19106 205.2
[M+Na]+ 443.17300 213.5
[M-H]- 419.17650 217.8
[M+NH4]+ 438.21760 222.8
[M+K]+ 459.14694 207.1
[M+H-H2O]+ 403.18104 197.3
[M+HCOO]- 465.18198 227.6
[M+CH3COO]- 479.19763 215.9
[M+Na-2H]- 441.15845 202.6
[M]+ 420.18323 208.8
[M]- 420.18433 208.8
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.