CID 20608147

Acetazolamide m5

Structural Information

Molecular Formula
C6H8N4O4S2
SMILES
CC(=O)NC1=NN=C(S1)S(=O)(=O)NC(=O)C
InChI
InChI=1S/C6H8N4O4S2/c1-3(11)7-5-8-9-6(15-5)16(13,14)10-4(2)12/h1-2H3,(H,10,12)(H,7,8,11)
InChIKey
BNUGZGQLPVRYHW-UHFFFAOYSA-N
Compound name
N-[5-(acetylsulfamoyl)-1,3,4-thiadiazol-2-yl]acetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

54
Patents

263.9987 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 265.00598 154.9
[M+Na]+ 286.98792 163.0
[M-H]- 262.99142 156.3
[M+NH4]+ 282.03252 170.3
[M+K]+ 302.96186 159.9
[M+H-H2O]+ 246.99596 148.3
[M+HCOO]- 308.99690 167.3
[M+CH3COO]- 323.01255 192.9
[M+Na-2H]- 284.97337 156.5
[M]+ 263.99815 157.9
[M]- 263.99925 157.9
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