CID 10844480

1802667-48-6

Structural Information

Molecular Formula
C7H10O3
SMILES
C1C[C@H]([C@H]2[C@@H]1CC(=O)O2)O
InChI
InChI=1S/C7H10O3/c8-5-2-1-4-3-6(9)10-7(4)5/h4-5,7-8H,1-3H2/t4-,5+,7+/m0/s1
InChIKey
MBJJGJACXCAZKL-HBPOCXIASA-N
Compound name
(3aS,6R,6aR)-6-hydroxy-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.06299 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.07027 127.0
[M+Na]+ 165.05221 135.7
[M+NH4]+ 160.09681 135.6
[M+K]+ 181.02615 135.3
[M-H]- 141.05571 128.3
[M+Na-2H]- 163.03766 128.3
[M]+ 142.06244 128.2
[M]- 142.06354 128.2
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.