CID 86703623

3-methoxyazetidine-1-sulfonamide

Structural Information

Molecular Formula
C4H10N2O3S
SMILES
COC1CN(C1)S(=O)(=O)N
InChI
InChI=1S/C4H10N2O3S/c1-9-4-2-6(3-4)10(5,7)8/h4H,2-3H2,1H3,(H2,5,7,8)
InChIKey
OHMNUYANSRMXGT-UHFFFAOYSA-N
Compound name
3-methoxyazetidine-1-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

55
Patents

166.04121 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.04849 128.7
[M+Na]+ 189.03043 134.4
[M-H]- 165.03393 130.3
[M+NH4]+ 184.07503 141.0
[M+K]+ 205.00437 136.8
[M+H-H2O]+ 149.03847 116.9
[M+HCOO]- 211.03941 144.2
[M+CH3COO]- 225.05506 179.1
[M+Na-2H]- 187.01588 132.1
[M]+ 166.04066 138.0
[M]- 166.04176 138.0
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