CID 46703768

4-ethoxy-3-pyridinesulfonamide

Structural Information

Molecular Formula
C7H10N2O3S
SMILES
CCOC1=C(C=NC=C1)S(=O)(=O)N
InChI
InChI=1S/C7H10N2O3S/c1-2-12-6-3-4-9-5-7(6)13(8,10)11/h3-5H,2H2,1H3,(H2,8,10,11)
InChIKey
MQJPVIGZIDYFMM-UHFFFAOYSA-N
Compound name
4-ethoxypyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

12
Patents

202.04121 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.04849 139.8
[M+Na]+ 225.03043 148.9
[M-H]- 201.03393 142.2
[M+NH4]+ 220.07503 157.7
[M+K]+ 241.00437 146.3
[M+H-H2O]+ 185.03847 133.4
[M+HCOO]- 247.03941 158.2
[M+CH3COO]- 261.05506 181.9
[M+Na-2H]- 223.01588 145.1
[M]+ 202.04066 142.5
[M]- 202.04176 142.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe