CID 7131438

4-(2-bromoethoxy)-n,n-dimethylbenzene-1-sulfonamide

Structural Information

Molecular Formula
C10H14BrNO3S
SMILES
CN(C)S(=O)(=O)C1=CC=C(C=C1)OCCBr
InChI
InChI=1S/C10H14BrNO3S/c1-12(2)16(13,14)10-5-3-9(4-6-10)15-8-7-11/h3-6H,7-8H2,1-2H3
InChIKey
IKIZPEDWXMNUTC-UHFFFAOYSA-N
Compound name
4-(2-bromoethoxy)-N,N-dimethylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.9878 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.99508 146.6
[M+Na]+ 329.97702 148.2
[M+NH4]+ 325.02162 150.6
[M+K]+ 345.95096 148.2
[M-H]- 305.98052 146.6
[M+Na-2H]- 327.96247 149.8
[M]+ 306.98725 145.9
[M]- 306.98835 145.9
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.