CID 3766663

2-ethoxy-5-(piperidine-1-sulfonyl)aniline

Structural Information

Molecular Formula
C13H20N2O3S
SMILES
CCOC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)N
InChI
InChI=1S/C13H20N2O3S/c1-2-18-13-7-6-11(10-12(13)14)19(16,17)15-8-4-3-5-9-15/h6-7,10H,2-5,8-9,14H2,1H3
InChIKey
DXACFDKIJJJJID-UHFFFAOYSA-N
Compound name
2-ethoxy-5-piperidin-1-ylsulfonylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.11948 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.12676 163.2
[M+Na]+ 307.10870 173.2
[M+NH4]+ 302.15330 170.1
[M+K]+ 323.08264 166.2
[M-H]- 283.11220 165.6
[M+Na-2H]- 305.09415 168.6
[M]+ 284.11893 165.5
[M]- 284.12003 165.5
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.