CID 39200931

2-hydrazinyl-5-(methoxymethyl)-1,3,4-thiadiazole

Structural Information

Molecular Formula
C4H8N4OS
SMILES
COCC1=NN=C(S1)NN
InChI
InChI=1S/C4H8N4OS/c1-9-2-3-7-8-4(6-5)10-3/h2,5H2,1H3,(H,6,8)
InChIKey
XGMNFKDBUFTWJM-UHFFFAOYSA-N
Compound name
[5-(methoxymethyl)-1,3,4-thiadiazol-2-yl]hydrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

160.04189 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 161.04917 128.2
[M+Na]+ 183.03111 137.2
[M-H]- 159.03461 129.5
[M+NH4]+ 178.07571 148.1
[M+K]+ 199.00505 135.5
[M+H-H2O]+ 143.03915 121.1
[M+HCOO]- 205.04009 148.9
[M+CH3COO]- 219.05574 177.8
[M+Na-2H]- 181.01656 132.4
[M]+ 160.04134 129.5
[M]- 160.04244 129.5
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

No patent data available for this compound.