CID 10844480

Rac-(3ar,6s,6as)-6-hydroxy-hexahydro-2h-cyclopenta[b]furan-2-one

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 126.9
[M+Na]+ 165.05221 134.9
[M-H]- 141.05571 130.8
[M+NH4]+ 160.09681 151.2
[M+K]+ 181.02615 134.6
[M+H-H2O]+ 125.06025 123.6
[M+HCOO]- 187.06119 147.4
[M+CH3COO]- 201.07684 169.2
[M+Na-2H]- 163.03766 130.9
[M]+ 142.06244 125.2
[M]- 142.06354 125.2
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.