CID 137935186

2253640-84-3

Structural Information

Molecular Formula
C7H10O4
SMILES
C1C2C(COC2CO1)C(=O)O
InChI
InChI=1S/C7H10O4/c8-7(9)5-2-11-6-3-10-1-4(5)6/h4-6H,1-3H2,(H,8,9)
InChIKey
AFUXPHITRMPTGF-UHFFFAOYSA-N
Compound name
2,3,3a,4,6,6a-hexahydrofuro[3,4-b]furan-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

158.0579 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.06518 130.4
[M+Na]+ 181.04712 138.3
[M+NH4]+ 176.09172 138.2
[M+K]+ 197.02106 139.4
[M-H]- 157.05062 132.2
[M+Na-2H]- 179.03257 130.6
[M]+ 158.05735 131.6
[M]- 158.05845 131.6
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.