CID 14310343

1508068-71-0

Structural Information

Molecular Formula
C7H10OS
SMILES
C1C2CSCC2CC1=O
InChI
InChI=1S/C7H10OS/c8-7-1-5-3-9-4-6(5)2-7/h5-6H,1-4H2
InChIKey
WGUHSXWRJNEGPK-UHFFFAOYSA-N
Compound name
1,3,3a,4,6,6a-hexahydrocyclopenta[c]thiophen-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

11
Patents

142.04524 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.05252 129.7
[M+Na]+ 165.03446 138.6
[M+NH4]+ 160.07906 140.2
[M+K]+ 181.00840 134.0
[M-H]- 141.03796 131.4
[M+Na-2H]- 163.01991 132.1
[M]+ 142.04469 131.7
[M]- 142.04579 131.7
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