CID 11378819

4-methoxyindoline-2,3-dione

Structural Information

Molecular Formula
C9H7NO3
SMILES
COC1=CC=CC2=C1C(=O)C(=O)N2
InChI
InChI=1S/C9H7NO3/c1-13-6-4-2-3-5-7(6)8(11)9(12)10-5/h2-4H,1H3,(H,10,11,12)
InChIKey
LTERBHLYBWXCPT-UHFFFAOYSA-N
Compound name
4-methoxy-1H-indole-2,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

92
Patents

177.04259 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.04987 134.7
[M+Na]+ 200.03181 146.7
[M+NH4]+ 195.07641 142.5
[M+K]+ 216.00575 143.2
[M-H]- 176.03531 134.9
[M+Na-2H]- 198.01726 138.8
[M]+ 177.04204 136.2
[M]- 177.04314 136.2
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