CID 343866

7403-18-1

Structural Information

Molecular Formula
C16H15N3O3S
SMILES
CC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC3=NC=CN=C23)OC
InChI
InChI=1S/C16H15N3O3S/c1-11-3-5-13(6-4-11)23(20,21)19-15-10-12(22-2)9-14-16(15)18-8-7-17-14/h3-10,19H,1-2H3
InChIKey
VSLTWIBKZONEPS-UHFFFAOYSA-N
Compound name
N-(7-methoxyquinoxalin-5-yl)-4-methylbenzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

329.0834 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.09068 174.3
[M+Na]+ 352.07262 184.0
[M-H]- 328.07612 179.7
[M+NH4]+ 347.11722 186.7
[M+K]+ 368.04656 178.6
[M+H-H2O]+ 312.08066 165.3
[M+HCOO]- 374.08160 190.4
[M+CH3COO]- 388.09725 208.4
[M+Na-2H]- 350.05807 181.4
[M]+ 329.08285 178.7
[M]- 329.08395 178.7
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

patents stripe