CID 141745912

2376514-25-7

Structural Information

Molecular Formula
C12H12O2
SMILES
C1CC2(CC2)C3=C1C=CC(=C3)C(=O)O
InChI
InChI=1S/C12H12O2/c13-11(14)9-2-1-8-3-4-12(5-6-12)10(8)7-9/h1-2,7H,3-6H2,(H,13,14)
InChIKey
ODQYJDKROKYGQS-UHFFFAOYSA-N
Compound name
spiro[1,2-dihydroindene-3,1'-cyclopropane]-5-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

188.08372 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.09100 143.9
[M+Na]+ 211.07294 157.0
[M+NH4]+ 206.11754 155.3
[M+K]+ 227.04688 151.9
[M-H]- 187.07644 153.4
[M+Na-2H]- 209.05839 152.8
[M]+ 188.08317 149.7
[M]- 188.08427 149.7
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.