CID 56445

Oxamide, n-(2-anthraquinonyl)-n'-(2-hydroxyethyl)-

Structural Information

Molecular Formula
C18H14N2O5
SMILES
C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)NC(=O)C(=O)NCCO
InChI
InChI=1S/C18H14N2O5/c21-8-7-19-17(24)18(25)20-10-5-6-13-14(9-10)16(23)12-4-2-1-3-11(12)15(13)22/h1-6,9,21H,7-8H2,(H,19,24)(H,20,25)
InChIKey
OZDAPRNNRROKQF-UHFFFAOYSA-N
Compound name
N'-(9,10-dioxoanthracen-2-yl)-N-(2-hydroxyethyl)oxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

338.09027 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 339.09755 175.0
[M+Na]+ 361.07949 185.5
[M+NH4]+ 356.12409 180.6
[M+K]+ 377.05343 180.3
[M-H]- 337.08299 176.5
[M+Na-2H]- 359.06494 178.1
[M]+ 338.08972 176.4
[M]- 338.09082 176.4
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.