CID 274137

2,5-diacetamido-1,3,4-thiadiazole

Structural Information

Molecular Formula
C6H8N4O2S
SMILES
CC(=O)NC1=NN=C(S1)NC(=O)C
InChI
InChI=1S/C6H8N4O2S/c1-3(11)7-5-9-10-6(13-5)8-4(2)12/h1-2H3,(H,7,9,11)(H,8,10,12)
InChIKey
WNFWPKKXILWSAT-UHFFFAOYSA-N
Compound name
N-(5-acetamido-1,3,4-thiadiazol-2-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
Patents

200.0368 Da
Monoisotopic Mass

-0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.04408 141.0
[M+Na]+ 223.02602 149.1
[M-H]- 199.02952 142.8
[M+NH4]+ 218.07062 159.3
[M+K]+ 238.99996 147.5
[M+H-H2O]+ 183.03406 133.7
[M+HCOO]- 245.03500 160.2
[M+CH3COO]- 259.05065 185.2
[M+Na-2H]- 221.01147 143.0
[M]+ 200.03625 142.6
[M]- 200.03735 142.6
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

patents stripe