CID 24709929

4-cyano-n-(2-methoxyethyl)benzene-1-sulfonamide

Structural Information

Molecular Formula
C10H12N2O3S
SMILES
COCCNS(=O)(=O)C1=CC=C(C=C1)C#N
InChI
InChI=1S/C10H12N2O3S/c1-15-7-6-12-16(13,14)10-4-2-9(8-11)3-5-10/h2-5,12H,6-7H2,1H3
InChIKey
ZFBAXVDFTYHDLQ-UHFFFAOYSA-N
Compound name
4-cyano-N-(2-methoxyethyl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.05687 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.06415 158.3
[M+Na]+ 263.04609 167.9
[M-H]- 239.04959 162.1
[M+NH4]+ 258.09069 174.3
[M+K]+ 279.02003 165.2
[M+H-H2O]+ 223.05413 145.6
[M+HCOO]- 285.05507 174.1
[M+CH3COO]- 299.07072 201.5
[M+Na-2H]- 261.03154 162.3
[M]+ 240.05632 157.0
[M]- 240.05742 157.0
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.