CID 87139669

1-formylcyclopropane-1-sulfonamide

Structural Information

Molecular Formula
C4H7NO3S
SMILES
C1CC1(C=O)S(=O)(=O)N
InChI
InChI=1S/C4H7NO3S/c5-9(7,8)4(3-6)1-2-4/h3H,1-2H2,(H2,5,7,8)
InChIKey
XTZWWIXDISJKIY-UHFFFAOYSA-N
Compound name
1-formylcyclopropane-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

149.01466 Da
Monoisotopic Mass

-1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.02194 134.4
[M+Na]+ 172.00388 144.3
[M+NH4]+ 167.04848 143.3
[M+K]+ 187.97782 138.7
[M-H]- 148.00738 140.7
[M+Na-2H]- 169.98933 141.6
[M]+ 149.01411 139.0
[M]- 149.01521 139.0
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