CID 12207383

5-(chloromethyl)-n,n-dimethylfuran-2-sulfonamide

Structural Information

Molecular Formula
C7H10ClNO3S
SMILES
CN(C)S(=O)(=O)C1=CC=C(O1)CCl
InChI
InChI=1S/C7H10ClNO3S/c1-9(2)13(10,11)7-4-3-6(5-8)12-7/h3-4H,5H2,1-2H3
InChIKey
IRBKLIJSQPGOFR-UHFFFAOYSA-N
Compound name
5-(chloromethyl)-N,N-dimethylfuran-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.00699 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.01427 144.8
[M+Na]+ 245.99621 154.7
[M-H]- 221.99971 151.5
[M+NH4]+ 241.04081 165.6
[M+K]+ 261.97015 153.5
[M+H-H2O]+ 206.00425 140.6
[M+HCOO]- 268.00519 160.9
[M+CH3COO]- 282.02084 187.1
[M+Na-2H]- 243.98166 148.6
[M]+ 223.00644 152.4
[M]- 223.00754 152.4
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.