CID 85708379

18539-93-0

Structural Information

Molecular Formula
C11H10O3
SMILES
C1COC2(O1)CC(=O)C3=CC=CC=C23
InChI
InChI=1S/C11H10O3/c12-10-7-11(13-5-6-14-11)9-4-2-1-3-8(9)10/h1-4H,5-7H2
InChIKey
DSRQEABFLNCFKB-UHFFFAOYSA-N
Compound name
spiro[1,3-dioxolane-2,3'-2H-indene]-1'-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.06299 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 191.07027 136.7
[M+Na]+ 213.05221 145.9
[M-H]- 189.05571 145.0
[M+NH4]+ 208.09681 160.5
[M+K]+ 229.02615 145.6
[M+H-H2O]+ 173.06025 132.9
[M+HCOO]- 235.06119 158.2
[M+CH3COO]- 249.07684 151.6
[M+Na-2H]- 211.03766 143.8
[M]+ 190.06244 137.2
[M]- 190.06354 137.2
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.