CID 2834946

15383-49-0

Structural Information

Molecular Formula
C10H12O8
SMILES
C1C(C(CC(C1C(=O)O)C(=O)O)C(=O)O)C(=O)O
InChI
InChI=1S/C10H12O8/c11-7(12)3-1-4(8(13)14)6(10(17)18)2-5(3)9(15)16/h3-6H,1-2H2,(H,11,12)(H,13,14)(H,15,16)(H,17,18)
InChIKey
ZPAKUZKMGJJMAA-UHFFFAOYSA-N
Compound name
cyclohexane-1,2,4,5-tetracarboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

7716
Patents

260.05322 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 261.06050 149.4
[M+Na]+ 283.04244 153.7
[M-H]- 259.04594 147.1
[M+NH4]+ 278.08704 162.6
[M+K]+ 299.01638 153.3
[M+H-H2O]+ 243.05048 144.6
[M+HCOO]- 305.05142 161.6
[M+CH3COO]- 319.06707 187.7
[M+Na-2H]- 281.02789 146.1
[M]+ 260.05267 145.5
[M]- 260.05377 145.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe