CID 43613981

N-cycloheptyl-n-methylsulfamoyl chloride

Structural Information

Molecular Formula
C8H16ClNO2S
SMILES
CN(C1CCCCCC1)S(=O)(=O)Cl
InChI
InChI=1S/C8H16ClNO2S/c1-10(13(9,11)12)8-6-4-2-3-5-7-8/h8H,2-7H2,1H3
InChIKey
XLLUVZGYTHEIIR-UHFFFAOYSA-N
Compound name
N-cycloheptyl-N-methylsulfamoyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

225.05902 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 226.06630 143.7
[M+Na]+ 248.04824 147.4
[M-H]- 224.05174 148.7
[M+NH4]+ 243.09284 161.8
[M+K]+ 264.02218 150.2
[M+H-H2O]+ 208.05628 138.5
[M+HCOO]- 270.05722 154.7
[M+CH3COO]- 284.07287 189.5
[M+Na-2H]- 246.03369 145.8
[M]+ 225.05847 140.9
[M]- 225.05957 140.9
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.