CID 10909699

2,2-dimethyl-1,3-dioxolane-4-carboxylic acid

Structural Information

Molecular Formula
C6H10O4
SMILES
CC1(OCC(O1)C(=O)O)C
InChI
InChI=1S/C6H10O4/c1-6(2)9-3-4(10-6)5(7)8/h4H,3H2,1-2H3,(H,7,8)
InChIKey
OZPFVBLDYBXHAF-UHFFFAOYSA-N
Compound name
2,2-dimethyl-1,3-dioxolane-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

730
Patents

146.0579 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.065176 125.9
[M+Na]+ 169.047118 133.8
[M-H]- 145.050624 129.7
[M+NH4]+ 164.091723 147.7
[M+K]+ 185.021058 136.1
[M+H-H2O]+ 129.055160 122.8
[M+HCOO]- 191.056101 145.9
[M+CH3COO]- 205.071751 169.5
[M+Na-2H]- 167.032566 132.6
[M]+ 146.05735142 127.1
[M]- 146.05844858 127.1
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

patents stripe