CID 12693992

3,4-dihydro-2h-spiro[naphthalene-1,3'-oxolane]-2',5'-dione

Structural Information

Molecular Formula
C13H12O3
SMILES
C1CC2=CC=CC=C2C3(C1)CC(=O)OC3=O
InChI
InChI=1S/C13H12O3/c14-11-8-13(12(15)16-11)7-3-5-9-4-1-2-6-10(9)13/h1-2,4,6H,3,5,7-8H2
InChIKey
DVWPADJMQGZCAA-UHFFFAOYSA-N
Compound name
spiro[2,3-dihydro-1H-naphthalene-4,3'-oxolane]-2',5'-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.07864 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.08592 144.3
[M+Na]+ 239.06786 152.8
[M-H]- 215.07136 151.6
[M+NH4]+ 234.11246 166.7
[M+K]+ 255.04180 150.5
[M+H-H2O]+ 199.07590 138.8
[M+HCOO]- 261.07684 163.9
[M+CH3COO]- 275.09249 157.9
[M+Na-2H]- 237.05331 150.5
[M]+ 216.07809 142.2
[M]- 216.07919 142.2
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.