CID 15562

Aminoethylisoselenouronium

Structural Information

Molecular Formula
C3H9N3Se
SMILES
C(C[Se]C(=N)N)N
InChI
InChI=1S/C3H9N3Se/c4-1-2-7-3(5)6/h1-2,4H2,(H3,5,6)
InChIKey
GKPUPGABNUMBOH-UHFFFAOYSA-N
Compound name
2-aminoethyl carbamimidoselenoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

166.99617 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.00345 133.2
[M+Na]+ 189.98539 138.2
[M-H]- 165.98889 132.2
[M+NH4]+ 185.02999 154.1
[M+K]+ 205.95933 137.2
[M+H-H2O]+ 149.99343 127.1
[M+HCOO]- 211.99437 157.8
[M+CH3COO]- 226.01002 176.7
[M+Na-2H]- 187.97084 137.1
[M]+ 166.99562 127.8
[M]- 166.99672 127.8
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.