CID 132398677

2307750-20-3

Structural Information

Molecular Formula
C7H11ClO4S
SMILES
C1[C@H]2COC[C@H]2O[C@@H]1CS(=O)(=O)Cl
InChI
InChI=1S/C7H11ClO4S/c8-13(9,10)4-6-1-5-2-11-3-7(5)12-6/h5-7H,1-4H2/t5-,6-,7+/m0/s1
InChIKey
KSGDWDXNVSASHM-LYFYHCNISA-N
Compound name
[(2S,3aS,6aS)-2,3,3a,4,6,6a-hexahydrofuro[2,3-c]furan-2-yl]methanesulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.00665 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.01393 146.6
[M+Na]+ 248.99587 155.8
[M-H]- 224.99937 152.7
[M+NH4]+ 244.04047 168.2
[M+K]+ 264.96981 155.5
[M+H-H2O]+ 209.00391 145.0
[M+HCOO]- 271.00485 157.2
[M+CH3COO]- 285.02050 180.2
[M+Na-2H]- 246.98132 149.9
[M]+ 226.00610 151.5
[M]- 226.00720 151.5
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.