CID 11622476

2,3-dioxoindoline-5-carboxamide

Structural Information

Molecular Formula
C9H6N2O3
SMILES
C1=CC2=C(C=C1C(=O)N)C(=O)C(=O)N2
InChI
InChI=1S/C9H6N2O3/c10-8(13)4-1-2-6-5(3-4)7(12)9(14)11-6/h1-3H,(H2,10,13)(H,11,12,14)
InChIKey
AARFXJVACBOQII-UHFFFAOYSA-N
Compound name
2,3-dioxo-1H-indole-5-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

21
Patents

190.03784 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.04512 136.3
[M+Na]+ 213.02706 145.8
[M-H]- 189.03056 138.5
[M+NH4]+ 208.07166 156.3
[M+K]+ 229.00100 142.4
[M+H-H2O]+ 173.03510 130.7
[M+HCOO]- 235.03604 157.8
[M+CH3COO]- 249.05169 181.5
[M+Na-2H]- 211.01251 140.0
[M]+ 190.03729 134.0
[M]- 190.03839 134.0
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