CID 92538

56799-32-7

Structural Information

Molecular Formula
C18H18N2O2
SMILES
CN(C)C1=C2C(=C(C=C1)N(C)C)C(=O)C3=CC=CC=C3C2=O
InChI
InChI=1S/C18H18N2O2/c1-19(2)13-9-10-14(20(3)4)16-15(13)17(21)11-7-5-6-8-12(11)18(16)22/h5-10H,1-4H3
InChIKey
OZMLRWPLFYWTPG-UHFFFAOYSA-N
Compound name
1,4-bis(dimethylamino)anthracene-9,10-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

128
Patents

294.13684 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.14412 166.2
[M+Na]+ 317.12606 174.8
[M-H]- 293.12956 174.7
[M+NH4]+ 312.17066 184.9
[M+K]+ 333.10000 172.5
[M+H-H2O]+ 277.13410 158.3
[M+HCOO]- 339.13504 189.5
[M+CH3COO]- 353.15069 219.0
[M+Na-2H]- 315.11151 170.9
[M]+ 294.13629 169.7
[M]- 294.13739 169.7
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.