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]+ 161.049166 128.2
[M+Na]+ 183.031108 137.2
[M-H]- 159.034614 129.5
[M+NH4]+ 178.075713 148.1
[M+K]+ 199.005048 135.5
[M+H-H2O]+ 143.039150 121.1
[M+HCOO]- 205.040091 148.9
[M+CH3COO]- 219.055741 177.8
[M+Na-2H]- 181.016556 132.4
[M]+ 160.04134142 129.5
[M]- 160.04243858 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.