CID 32092

2,3-dihydroxy-1,4-phenazinedione

Structural Information

Molecular Formula
C12H6N2O4
SMILES
C1=CC=C2C(=C1)NC3=C(N2)C(=O)C(=O)C(=O)C3=O
InChI
InChI=1S/C12H6N2O4/c15-9-7-8(10(16)12(18)11(9)17)14-6-4-2-1-3-5(6)13-7/h1-4,13-14H
InChIKey
RKNYQLOSDNLISG-UHFFFAOYSA-N
Compound name
5,10-dihydrophenazine-1,2,3,4-tetrone
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

14
Patents

242.03276 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 243.040036 147.6
[M+Na]+ 265.021978 159.9
[M-H]- 241.025484 148.9
[M+NH4]+ 260.066583 163.5
[M+K]+ 280.995918 153.9
[M+H-H2O]+ 225.030020 140.4
[M+HCOO]- 287.030961 165.0
[M+CH3COO]- 301.046611 159.9
[M+Na-2H]- 263.007426 155.2
[M]+ 242.03221142 147.0
[M]- 242.03330858 147.0
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