CID 135697357

6-hydroxyphenazine-1-carboxylate

Structural Information

Molecular Formula
C13H8N2O3
SMILES
C1=CC(=C2C(=C1)N=C3C(=N2)C=CC=C3O)C(=O)O
InChI
InChI=1S/C13H8N2O3/c16-10-6-2-5-9-12(10)15-8-4-1-3-7(13(17)18)11(8)14-9/h1-6,16H,(H,17,18)
InChIKey
QXWUQPXBVUWEOH-UHFFFAOYSA-N
Compound name
6-hydroxyphenazine-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

13
Patents

240.0535 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.06078 149.4
[M+Na]+ 263.04272 160.5
[M-H]- 239.04622 150.7
[M+NH4]+ 258.08732 165.2
[M+K]+ 279.01666 155.5
[M+H-H2O]+ 223.05076 141.8
[M+HCOO]- 285.05170 167.7
[M+CH3COO]- 299.06735 161.6
[M+Na-2H]- 261.02817 158.8
[M]+ 240.05295 151.2
[M]- 240.05405 151.2
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