CID 327365

64876-49-9

Structural Information

Molecular Formula
C13H19N3O4S
SMILES
CC(C)N(CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N)C(=O)C
InChI
InChI=1S/C13H19N3O4S/c1-9(2)16(10(3)17)8-13(18)15-11-4-6-12(7-5-11)21(14,19)20/h4-7,9H,8H2,1-3H3,(H,15,18)(H2,14,19,20)
InChIKey
LGDGXAAWKHDBGZ-UHFFFAOYSA-N
Compound name
2-[acetyl(propan-2-yl)amino]-N-(4-sulfamoylphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

313.10962 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 314.11690 170.6
[M+Na]+ 336.09884 174.7
[M-H]- 312.10234 174.6
[M+NH4]+ 331.14344 184.5
[M+K]+ 352.07278 173.5
[M+H-H2O]+ 296.10688 162.9
[M+HCOO]- 358.10782 188.0
[M+CH3COO]- 372.12347 212.9
[M+Na-2H]- 334.08429 170.5
[M]+ 313.10907 172.6
[M]- 313.11017 172.6
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.