CID 398202

Brn 0674907

Structural Information

Molecular Formula
C17H12N2O2
SMILES
C1=CC=C2C(=C1)C=CC3=CC=CC=C3C24C(=O)NC(=O)N4
InChI
InChI=1S/C17H12N2O2/c20-15-17(19-16(21)18-15)13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,18,19,20,21)
InChIKey
KQWVJJYTFRIQCS-UHFFFAOYSA-N
Compound name
spiro[imidazolidine-5,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene]-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

276.08987 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 277.097146 164.7
[M+Na]+ 299.079088 174.1
[M-H]- 275.082594 169.2
[M+NH4]+ 294.123693 182.0
[M+K]+ 315.053028 169.7
[M+H-H2O]+ 259.087130 157.4
[M+HCOO]- 321.088071 180.4
[M+CH3COO]- 335.103721 175.3
[M+Na-2H]- 297.064536 170.1
[M]+ 276.08932142 158.7
[M]- 276.09041858 158.7
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.