CID 66851680

106237-17-6

Structural Information

Molecular Formula
C10H14O3
SMILES
C1C2CC3CC1CC(C2)(O3)C(=O)O
InChI
InChI=1S/C10H14O3/c11-9(12)10-4-6-1-7(5-10)3-8(2-6)13-10/h6-8H,1-5H2,(H,11,12)
InChIKey
SDGBFSSBRFDOKB-UHFFFAOYSA-N
Compound name
2-oxatricyclo[3.3.1.13,7]decane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

182.0943 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.10158 138.7
[M+Na]+ 205.08352 147.6
[M+NH4]+ 200.12812 150.9
[M+K]+ 221.05746 140.1
[M-H]- 181.08702 137.0
[M+Na-2H]- 203.06897 135.1
[M]+ 182.09375 139.5
[M]- 182.09485 139.5
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

patents stripe