CID 515955

Chembl357319

Structural Information

Molecular Formula

C₁₁H₁₀N₂O₃

SMILES

CNC(=O)C1=CC2=C(C=C1)N(C(=O)C2=O)C

InChI

InChI=1S/C11H10N2O3/c1-12-10(15)6-3-4-8-7(5-6)9(14)11(16)13(8)2/h3-5H,1-2H3,(H,12,15)

InChIKey

LQWQFWDSRGNXMV-UHFFFAOYSA-N

Compound name

N,1-dimethyl-2,3-dioxoindole-5-carboxamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 218.06914 Da
Monoisotopic Mass: -0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	219.076416	144.2
[M+Na]+	241.058358	154.3
[M-H]-	217.061864	148.4
[M+NH4]+	236.102963	164.6
[M+K]+	257.032298	151.7
[M+H-H2O]+	201.066400	138.4
[M+HCOO]-	263.067341	167.3
[M+CH3COO]-	277.082991	191.2
[M+Na-2H]-	239.043806	147.8
[M]+	218.06859142	145.8
[M]-	218.06968858	145.8

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.