CID 2723832

62435-72-7

Structural Information

Molecular Formula
C8H12O5
SMILES
COC1C=CC(O1)(C(=O)OC)OC
InChI
InChI=1S/C8H12O5/c1-10-6-4-5-8(12-3,13-6)7(9)11-2/h4-6H,1-3H3
InChIKey
GHVXSSBZJZUDSO-UHFFFAOYSA-N
Compound name
methyl 2,5-dimethoxy-2H-furan-5-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

188.06847 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.07575 135.0
[M+Na]+ 211.05769 143.5
[M-H]- 187.06119 139.7
[M+NH4]+ 206.10229 157.3
[M+K]+ 227.03163 145.8
[M+H-H2O]+ 171.06573 131.0
[M+HCOO]- 233.06667 158.6
[M+CH3COO]- 247.08232 178.9
[M+Na-2H]- 209.04314 141.4
[M]+ 188.06792 141.1
[M]- 188.06902 141.1
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.