CID 2761302

5-ethoxy-1,2,4-thiadiazol-3-amine

Structural Information

Molecular Formula
C4H7N3OS
SMILES
CCOC1=NC(=NS1)N
InChI
InChI=1S/C4H7N3OS/c1-2-8-4-6-3(5)7-9-4/h2H2,1H3,(H2,5,7)
InChIKey
IXAWHRSYSKUNOL-UHFFFAOYSA-N
Compound name
5-ethoxy-1,2,4-thiadiazol-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

145.03099 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 146.03827 125.4
[M+Na]+ 168.02021 135.4
[M-H]- 144.02371 126.8
[M+NH4]+ 163.06481 146.3
[M+K]+ 183.99415 133.9
[M+H-H2O]+ 128.02825 118.9
[M+HCOO]- 190.02919 145.1
[M+CH3COO]- 204.04484 172.8
[M+Na-2H]- 166.00566 128.8
[M]+ 145.03044 127.5
[M]- 145.03154 127.5
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.