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

43
Patents

166.04121 Da
Monoisotopic Mass

-1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 167.048486 128.7
[M+Na]+ 189.030428 134.4
[M-H]- 165.033934 130.3
[M+NH4]+ 184.075033 141.0
[M+K]+ 205.004368 136.8
[M+H-H2O]+ 149.038470 116.9
[M+HCOO]- 211.039411 144.2
[M+CH3COO]- 225.055061 179.1
[M+Na-2H]- 187.015876 132.1
[M]+ 166.04066142 138.0
[M]- 166.04175858 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