CID 64541407

Methyl 2-(cyclopropylsulfamoyl)acetate

Structural Information

Molecular Formula
C6H11NO4S
SMILES
COC(=O)CS(=O)(=O)NC1CC1
InChI
InChI=1S/C6H11NO4S/c1-11-6(8)4-12(9,10)7-5-2-3-5/h5,7H,2-4H2,1H3
InChIKey
VBAOCRAHNCYUST-UHFFFAOYSA-N
Compound name
methyl 2-(cyclopropylsulfamoyl)acetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.04088 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.04816 137.2
[M+Na]+ 216.03010 145.8
[M-H]- 192.03360 141.8
[M+NH4]+ 211.07470 151.8
[M+K]+ 232.00404 143.3
[M+H-H2O]+ 176.03814 131.3
[M+HCOO]- 238.03908 155.8
[M+CH3COO]- 252.05473 183.5
[M+Na-2H]- 214.01555 141.6
[M]+ 193.04033 143.3
[M]- 193.04143 143.3
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

No patent data available for this compound.