CID 55252073

72525-30-5

Structural Information

Molecular Formula
C4H8BOS
SMILES
[B-][O+]1CCSCC1
InChI
InChI=1S/C4H8BOS/c5-6-1-3-7-4-2-6/h1-4H2
InChIKey
ZBIVZNCAWBSZBJ-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

115.038895 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 116.04617 118.3
[M+Na]+ 138.02811 124.0
[M-H]- 114.03162 121.0
[M+NH4]+ 133.07272 139.1
[M+K]+ 154.00205 119.3
[M+H-H2O]+ 98.036155 118.6
[M+HCOO]- 160.03710 133.3
[M+CH3COO]- 174.05275 156.3
[M+Na-2H]- 136.01356 124.4
[M]+ 115.03835 112.6
[M]- 115.03944 112.6
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.