CID 15633294

135922-85-9

Structural Information

Molecular Formula
C9H10O4
SMILES
C1C2C3C4C3(OC2C4CO1)C(=O)O
InChI
InChI=1S/C9H10O4/c10-8(11)9-5-3-1-12-2-4(6(5)9)7(3)13-9/h3-7H,1-2H2,(H,10,11)
InChIKey
GTTUKRXCHWFGCO-UHFFFAOYSA-N
Compound name
5,9-dioxatetracyclo[4.4.0.02,4.03,7]decane-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.0579 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.06518 131.0
[M+Na]+ 205.04712 140.6
[M+NH4]+ 200.09172 142.9
[M+K]+ 221.02106 142.2
[M-H]- 181.05062 138.9
[M+Na-2H]- 203.03257 131.5
[M]+ 182.05735 135.8
[M]- 182.05845 135.8
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.