CID 71753034

Zonisamide n,n-dimethylformimidamide

Structural Information

Molecular Formula
C11H13N3O3S
SMILES
CN(C)/C=N/S(=O)(=O)CC1=NOC2=CC=CC=C21
InChI
InChI=1S/C11H13N3O3S/c1-14(2)8-12-18(15,16)7-10-9-5-3-4-6-11(9)17-13-10/h3-6,8H,7H2,1-2H3/b12-8+
InChIKey
IIGSDTSFCPJXKF-XYOKQWHBSA-N
Compound name
N'-(1,2-benzoxazol-3-ylmethylsulfonyl)-N,N-dimethylmethanimidamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

267.06775 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 268.075026 157.6
[M+Na]+ 290.056968 167.7
[M-H]- 266.060474 165.1
[M+NH4]+ 285.101573 175.8
[M+K]+ 306.030908 166.8
[M+H-H2O]+ 250.065010 150.7
[M+HCOO]- 312.065951 179.9
[M+CH3COO]- 326.081601 201.2
[M+Na-2H]- 288.042416 165.1
[M]+ 267.06720142 166.1
[M]- 267.06829858 166.1
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.