CID 12328189

Cyanomethanesulfonamide

Structural Information

Molecular Formula
C2H4N2O2S
SMILES
C(C#N)S(=O)(=O)N
InChI
InChI=1S/C2H4N2O2S/c3-1-2-7(4,5)6/h2H2,(H2,4,5,6)
InChIKey
PLEATGIFHFOQGS-UHFFFAOYSA-N
Compound name
cyanomethanesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

144
Patents

119.99935 Da
Monoisotopic Mass

-2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 121.00663 126.2
[M+Na]+ 142.98857 136.4
[M-H]- 118.99207 127.8
[M+NH4]+ 138.03317 146.4
[M+K]+ 158.96251 136.3
[M+H-H2O]+ 102.99661 115.3
[M+HCOO]- 164.99755 142.0
[M+CH3COO]- 179.01320 180.6
[M+Na-2H]- 140.97402 130.9
[M]+ 119.99880 122.0
[M]- 119.99990 122.0
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