CID 72720

1,2,3-thiadiazole-4-carbohydrazide

Structural Information

Molecular Formula
C3H4N4OS
SMILES
C1=C(N=NS1)C(=O)NN
InChI
InChI=1S/C3H4N4OS/c4-5-3(8)2-1-9-7-6-2/h1H,4H2,(H,5,8)
InChIKey
GBBQRNGEDIWRJI-UHFFFAOYSA-N
Compound name
thiadiazole-4-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

64
Patents

144.01057 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 145.01785 124.4
[M+Na]+ 166.99979 133.0
[M-H]- 143.00329 125.7
[M+NH4]+ 162.04439 144.5
[M+K]+ 182.97373 131.5
[M+H-H2O]+ 127.00783 117.3
[M+HCOO]- 189.00877 144.5
[M+CH3COO]- 203.02442 172.9
[M+Na-2H]- 164.98524 128.5
[M]+ 144.01002 123.5
[M]- 144.01112 123.5
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

patents stripe