CID 1419752

4-methyl-1,2,3-thiadiazole-5-carbohydrazide

Structural Information

Molecular Formula
C4H6N4OS
SMILES
CC1=C(SN=N1)C(=O)NN
InChI
InChI=1S/C4H6N4OS/c1-2-3(4(9)6-5)10-8-7-2/h5H2,1H3,(H,6,9)
InChIKey
OIZCCHUUSZFPIW-UHFFFAOYSA-N
Compound name
4-methylthiadiazole-5-carbohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

62
Patents

158.02623 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.03351 129.1
[M+Na]+ 181.01545 138.2
[M-H]- 157.01895 130.6
[M+NH4]+ 176.06005 149.0
[M+K]+ 196.98939 136.4
[M+H-H2O]+ 141.02349 122.2
[M+HCOO]- 203.02443 148.9
[M+CH3COO]- 217.04008 177.1
[M+Na-2H]- 179.00090 132.1
[M]+ 158.02568 129.0
[M]- 158.02678 129.0
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