CID 3065451

108097-76-3

Structural Information

Molecular Formula
C10H10O5
SMILES
CC1(C=C(C2=C(O1)C(=O)OC2)C(=O)O)C
InChI
InChI=1S/C10H10O5/c1-10(2)3-5(8(11)12)6-4-14-9(13)7(6)15-10/h3H,4H2,1-2H3,(H,11,12)
InChIKey
CXKSYUVBLKDHAF-UHFFFAOYSA-N
Compound name
2,2-dimethyl-7-oxo-5H-furo[3,4-b]pyran-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

210.05283 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 211.06011 140.9
[M+Na]+ 233.04205 151.6
[M+NH4]+ 228.08665 149.2
[M+K]+ 249.01599 148.6
[M-H]- 209.04555 143.1
[M+Na-2H]- 231.02750 143.8
[M]+ 210.05228 143.0
[M]- 210.05338 143.0
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.