CID 155820847

2490420-63-6

Structural Information

Molecular Formula
C11H11NO3
SMILES
C1CC2(C3=C(C1=O)N=CC=C3)OCCO2
InChI
InChI=1S/C11H11NO3/c13-9-3-4-11(14-6-7-15-11)8-2-1-5-12-10(8)9/h1-2,5H,3-4,6-7H2
InChIKey
PVQGANNPJVKETM-UHFFFAOYSA-N
Compound name
spiro[1,3-dioxolane-2,5'-6,7-dihydroquinoline]-8'-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

205.0739 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 206.08118 140.4
[M+Na]+ 228.06312 148.7
[M-H]- 204.06662 146.8
[M+NH4]+ 223.10772 160.3
[M+K]+ 244.03706 148.4
[M+H-H2O]+ 188.07116 134.0
[M+HCOO]- 250.07210 158.3
[M+CH3COO]- 264.08775 153.8
[M+Na-2H]- 226.04857 148.7
[M]+ 205.07335 139.1
[M]- 205.07445 139.1
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.