CID 327874

1,3,4-selenadiazol-2-amine

Structural Information

Molecular Formula
C2H3N3Se
SMILES
C1=NN=C([Se]1)N
InChI
InChI=1S/C2H3N3Se/c3-2-5-4-1-6-2/h1H,(H2,3,5)
InChIKey
MCBOINOJZQFGBM-UHFFFAOYSA-N
Compound name
1,3,4-selenadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

148.94922 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 149.95650 123.4
[M+Na]+ 171.93844 131.9
[M-H]- 147.94194 123.7
[M+NH4]+ 166.98304 145.2
[M+K]+ 187.91238 131.0
[M+H-H2O]+ 131.94648 116.0
[M+HCOO]- 193.94742 147.8
[M+CH3COO]- 207.96307 165.1
[M+Na-2H]- 169.92389 130.5
[M]+ 148.94867 121.1
[M]- 148.94977 121.1
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