CID 43611014

N-methyl-n-(oxan-4-yl)sulfamoyl chloride

Structural Information

Molecular Formula
C6H12ClNO3S
SMILES
CN(C1CCOCC1)S(=O)(=O)Cl
InChI
InChI=1S/C6H12ClNO3S/c1-8(12(7,9)10)6-2-4-11-5-3-6/h6H,2-5H2,1H3
InChIKey
ZWWBGYONISXJSE-UHFFFAOYSA-N
Compound name
N-methyl-N-(oxan-4-yl)sulfamoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

213.02264 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 214.02992 140.5
[M+Na]+ 236.01186 146.9
[M-H]- 212.01536 145.9
[M+NH4]+ 231.05646 159.3
[M+K]+ 251.98580 146.4
[M+H-H2O]+ 196.01990 136.0
[M+HCOO]- 258.02084 152.1
[M+CH3COO]- 272.03649 184.1
[M+Na-2H]- 233.99731 145.3
[M]+ 213.02209 142.6
[M]- 213.02319 142.6
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.