CID 50986166

5,10-dihydrophenazine-1-carboxylate

Structural Information

Molecular Formula
C13H10N2O2
SMILES
C1=CC=C2C(=C1)NC3=CC=CC(=C3N2)C(=O)O
InChI
InChI=1S/C13H10N2O2/c16-13(17)8-4-3-7-11-12(8)15-10-6-2-1-5-9(10)14-11/h1-7,14-15H,(H,16,17)
InChIKey
RWCXEOMFBZOODX-UHFFFAOYSA-N
Compound name
5,10-dihydrophenazine-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

3
References

30
Patents

226.07423 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.081506 148.0
[M+Na]+ 249.063448 155.9
[M-H]- 225.066954 146.6
[M+NH4]+ 244.108053 163.2
[M+K]+ 265.037388 149.7
[M+H-H2O]+ 209.071490 140.7
[M+HCOO]- 271.072431 161.8
[M+CH3COO]- 285.088081 158.3
[M+Na-2H]- 247.048896 155.7
[M]+ 226.07368142 143.3
[M]- 226.07477858 143.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe