CID 213193

Brn 3007377

Structural Information

Molecular Formula
C20H15NO4
SMILES
CN(C)C1=CC=CC2=C1C(=O)C3=C(C4=CC=CC=C4C(=C3C2=O)O)O
InChI
InChI=1S/C20H15NO4/c1-21(2)13-9-5-8-12-14(13)20(25)16-15(19(12)24)17(22)10-6-3-4-7-11(10)18(16)23/h3-9,22-23H,1-2H3
InChIKey
NKDNNGOGUCUKEI-UHFFFAOYSA-N
Compound name
1-(dimethylamino)-6,11-dihydroxytetracene-5,12-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

333.1001 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.107376 173.6
[M+Na]+ 356.089318 183.6
[M-H]- 332.092824 179.4
[M+NH4]+ 351.133923 189.9
[M+K]+ 372.063258 179.1
[M+H-H2O]+ 316.097360 165.9
[M+HCOO]- 378.098301 191.3
[M+CH3COO]- 392.113951 184.9
[M+Na-2H]- 354.074766 178.5
[M]+ 333.09955142 175.9
[M]- 333.10064858 175.9
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.