CID 10862795

Foramsulfuron tp

Structural Information

Molecular Formula
C16H20N6O6S
SMILES
CN(C)C(=O)C1=C(C=C(C=C1)N)S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)OC)OC
InChI
InChI=1S/C16H20N6O6S/c1-22(2)14(23)10-6-5-9(17)7-11(10)29(25,26)21-16(24)20-15-18-12(27-3)8-13(19-15)28-4/h5-8H,17H2,1-4H3,(H2,18,19,20,21,24)
InChIKey
DABUZOZWMXEZGZ-UHFFFAOYSA-N
Compound name
4-amino-2-[(4,6-dimethoxypyrimidin-2-yl)carbamoylsulfamoyl]-N,N-dimethylbenzamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

11
Patents

424.11652 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 425.12380 192.9
[M+Na]+ 447.10574 199.4
[M+NH4]+ 442.15034 194.5
[M+K]+ 463.07968 197.1
[M-H]- 423.10924 193.6
[M+Na-2H]- 445.09119 196.8
[M]+ 424.11597 193.7
[M]- 424.11707 193.7
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