CID 145867694

2375273-87-1

Structural Information

Molecular Formula
C10H14O2
SMILES
C1C2CC(C1CC(=O)O)C3C2C3
InChI
InChI=1S/C10H14O2/c11-10(12)3-6-1-5-2-7(6)9-4-8(5)9/h5-9H,1-4H2,(H,11,12)
InChIKey
NVMBEBTXXPMSTD-UHFFFAOYSA-N
Compound name
2-(6-tricyclo[3.2.1.02,4]octanyl)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

166.09938 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.10666 136.5
[M+Na]+ 189.08860 146.3
[M-H]- 165.09210 139.9
[M+NH4]+ 184.13320 157.6
[M+K]+ 205.06254 141.8
[M+H-H2O]+ 149.09664 133.1
[M+HCOO]- 211.09758 154.6
[M+CH3COO]- 225.11323 181.9
[M+Na-2H]- 187.07405 139.5
[M]+ 166.09883 138.9
[M]- 166.09993 138.9
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.