CID 79589

Tetramethyl ethane-1,1,2,2-tetracarboxylate

Structural Information

Molecular Formula
C10H14O8
SMILES
COC(=O)C(C(C(=O)OC)C(=O)OC)C(=O)OC
InChI
InChI=1S/C10H14O8/c1-15-7(11)5(8(12)16-2)6(9(13)17-3)10(14)18-4/h5-6H,1-4H3
InChIKey
YFBFTGJJUOXWIC-UHFFFAOYSA-N
Compound name
tetramethyl ethane-1,1,2,2-tetracarboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

29
Patents

262.06888 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.07616 151.4
[M+Na]+ 285.05810 156.7
[M-H]- 261.06160 151.5
[M+NH4]+ 280.10270 167.6
[M+K]+ 301.03204 160.3
[M+H-H2O]+ 245.06614 146.0
[M+HCOO]- 307.06708 170.9
[M+CH3COO]- 321.08273 194.8
[M+Na-2H]- 283.04355 150.0
[M]+ 262.06833 159.1
[M]- 262.06943 159.1
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