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]+ 334.10738 173.6
[M+Na]+ 356.08932 183.6
[M-H]- 332.09282 179.4
[M+NH4]+ 351.13392 189.9
[M+K]+ 372.06326 179.1
[M+H-H2O]+ 316.09736 165.9
[M+HCOO]- 378.09830 191.3
[M+CH3COO]- 392.11395 184.9
[M+Na-2H]- 354.07477 178.5
[M]+ 333.09955 175.9
[M]- 333.10065 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.