CID 70580

1034-46-4

Structural Information

Molecular Formula
C18H15NO2
SMILES
C1CC2=CC=CC=C2C3(CC(=O)NC3=O)C4=CC=CC=C41
InChI
InChI=1S/C18H15NO2/c20-16-11-18(17(21)19-16)14-7-3-1-5-12(14)9-10-13-6-2-4-8-15(13)18/h1-8H,9-11H2,(H,19,20,21)
InChIKey
SWXGTCKIGMOVFI-UHFFFAOYSA-N
Compound name
spiro[pyrrolidine-3,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,11,13-hexaene]-2,5-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

277.1103 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 278.11758 165.0
[M+Na]+ 300.09952 173.2
[M-H]- 276.10302 171.5
[M+NH4]+ 295.14412 184.1
[M+K]+ 316.07346 169.4
[M+H-H2O]+ 260.10756 158.8
[M+HCOO]- 322.10850 181.6
[M+CH3COO]- 336.12415 176.0
[M+Na-2H]- 298.08497 169.4
[M]+ 277.10975 159.0
[M]- 277.11085 159.0
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