CID 18553

3204-78-2

Structural Information

Molecular Formula
C11H18O2
SMILES
C1CCC(CC1)C2CC(C2)C(=O)O
InChI
InChI=1S/C11H18O2/c12-11(13)10-6-9(7-10)8-4-2-1-3-5-8/h8-10H,1-7H2,(H,12,13)
InChIKey
CWCBASCSGVOBLJ-UHFFFAOYSA-N
Compound name
3-cyclohexylcyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

182.13068 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 183.13796 143.0
[M+Na]+ 205.11990 148.0
[M+NH4]+ 200.16450 147.4
[M+K]+ 221.09384 144.6
[M-H]- 181.12340 142.6
[M+Na-2H]- 203.10535 144.8
[M]+ 182.13013 142.1
[M]- 182.13123 142.1
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.