CID 90131688

1603068-17-2

Structural Information

Molecular Formula
C11H9NO2
SMILES
C1C(=O)CC12C3=CC=CC=C3NC2=O
InChI
InChI=1S/C11H9NO2/c13-7-5-11(6-7)8-3-1-2-4-9(8)12-10(11)14/h1-4H,5-6H2,(H,12,14)
InChIKey
DIBPKWQRMFSZTH-UHFFFAOYSA-N
Compound name
spiro[1H-indole-3,3'-cyclobutane]-1',2-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

187.06332 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.07060 134.8
[M+Na]+ 210.05254 143.6
[M-H]- 186.05604 139.5
[M+NH4]+ 205.09714 151.5
[M+K]+ 226.02648 142.4
[M+H-H2O]+ 170.06058 125.1
[M+HCOO]- 232.06152 154.3
[M+CH3COO]- 246.07717 181.4
[M+Na-2H]- 208.03799 141.1
[M]+ 187.06277 141.5
[M]- 187.06387 141.5
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