CID 14651989

126674-93-9

Structural Information

Molecular Formula
C8H3F2NO2
SMILES
C1=C(C=C(C2=C1NC(=O)C2=O)F)F
InChI
InChI=1S/C8H3F2NO2/c9-3-1-4(10)6-5(2-3)11-8(13)7(6)12/h1-2H,(H,11,12,13)
InChIKey
YIVXDNUTNIKQMY-UHFFFAOYSA-N
Compound name
4,6-difluoro-1H-indole-2,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

89
Patents

183.01318 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.020456 130.0
[M+Na]+ 206.002398 142.1
[M-H]- 182.005904 130.5
[M+NH4]+ 201.047003 151.4
[M+K]+ 221.976338 137.9
[M+H-H2O]+ 166.010440 123.3
[M+HCOO]- 228.011381 150.0
[M+CH3COO]- 242.027031 178.5
[M+Na-2H]- 203.987846 134.1
[M]+ 183.01263142 127.2
[M]- 183.01372858 127.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe