CID 2060302

496057-29-5

Structural Information

Molecular Formula
C6H9N3OS
SMILES
CC1=NC(=CS1)CC(=O)NN
InChI
InChI=1S/C6H9N3OS/c1-4-8-5(3-11-4)2-6(10)9-7/h3H,2,7H2,1H3,(H,9,10)
InChIKey
NDJALHUEWYOORP-UHFFFAOYSA-N
Compound name
2-(2-methyl-1,3-thiazol-4-yl)acetohydrazide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

12
Patents

171.04663 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.053906 134.2
[M+Na]+ 194.035848 142.3
[M-H]- 170.039354 136.7
[M+NH4]+ 189.080453 154.9
[M+K]+ 210.009788 140.1
[M+H-H2O]+ 154.043890 127.6
[M+HCOO]- 216.044831 154.5
[M+CH3COO]- 230.060481 180.3
[M+Na-2H]- 192.021296 136.2
[M]+ 171.04608142 134.3
[M]- 171.04717858 134.3
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