CID 116196

Brn 1489704

Structural Information

Molecular Formula
C19H17NO2
SMILES
C1CC2=CC=CC=C2C3(CC(=O)CNC3=O)C4=CC=CC=C41
InChI
InChI=1S/C19H17NO2/c21-15-11-19(18(22)20-12-15)16-7-3-1-5-13(16)9-10-14-6-2-4-8-17(14)19/h1-8H,9-12H2,(H,20,22)
InChIKey
FIYNHISZEOBKKX-UHFFFAOYSA-N
Compound name
spiro[piperidine-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

0
Patents

291.12592 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 292.13320 168.1
[M+Na]+ 314.11514 174.9
[M-H]- 290.11864 173.6
[M+NH4]+ 309.15974 184.7
[M+K]+ 330.08908 171.7
[M+H-H2O]+ 274.12318 160.8
[M+HCOO]- 336.12412 182.1
[M+CH3COO]- 350.13977 177.8
[M+Na-2H]- 312.10059 173.8
[M]+ 291.12537 160.2
[M]- 291.12647 160.2
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

No patent data available for this compound.