CID 59141300

Sulfinylidenemethanethione

Structural Information

Molecular Formula
COS2
SMILES
C(=S)=S=O
InChI
InChI=1S/COS2/c2-4-1-3
InChIKey
MRGNQEVEBMBQRB-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

1
Patents

91.93906 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 92.946336 109.0
[M+Na]+ 114.92828 119.0
[M-H]- 90.931784 110.2
[M+NH4]+ 109.97288 133.0
[M+K]+ 130.90222 116.1
[M+H-H2O]+ 74.936320 105.0
[M+HCOO]- 136.93726 123.5
[M+CH3COO]- 150.95291 160.1
[M+Na-2H]- 112.91373 111.9
[M]+ 91.938511 110.3
[M]- 91.939609 110.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe