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]+ 278.117576 165.0
[M+Na]+ 300.099518 173.2
[M-H]- 276.103024 171.5
[M+NH4]+ 295.144123 184.1
[M+K]+ 316.073458 169.4
[M+H-H2O]+ 260.107560 158.8
[M+HCOO]- 322.108501 181.6
[M+CH3COO]- 336.124151 176.0
[M+Na-2H]- 298.084966 169.4
[M]+ 277.10975142 159.0
[M]- 277.11084858 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