CID 514165

2h-1,3,5-thiadiazine-2,4(3h)-dione, 6-(4-methoxyphenyl)-

Structural Information

Molecular Formula
C10H8N2O3S
SMILES
COC1=CC=C(C=C1)C2=NC(=O)NC(=O)S2
InChI
InChI=1S/C10H8N2O3S/c1-15-7-4-2-6(3-5-7)8-11-9(13)12-10(14)16-8/h2-5H,1H3,(H,12,13,14)
InChIKey
DDDYGHGPJGVXGA-UHFFFAOYSA-N
Compound name
6-(4-methoxyphenyl)-1,3,5-thiadiazine-2,4-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

236.02556 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 237.03284 146.6
[M+Na]+ 259.01478 157.9
[M-H]- 235.01828 150.6
[M+NH4]+ 254.05938 161.8
[M+K]+ 274.98872 152.9
[M+H-H2O]+ 219.02282 139.0
[M+HCOO]- 281.02376 164.1
[M+CH3COO]- 295.03941 184.8
[M+Na-2H]- 257.00023 151.0
[M]+ 236.02501 149.6
[M]- 236.02611 149.6
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

No patent data available for this compound.