CID 6328104

Selenourea, n,n-diethyl-

Structural Information

Molecular Formula

C₅H₁₁N₂Se

SMILES

CCN(CC)C(=N)[Se]

InChI

InChI=1S/C5H11N2Se/c1-3-7(4-2)5(6)8/h6H,3-4H2,1-2H3

InChIKey

UEGLSOSLURUDIU-UHFFFAOYSA-N

Compound name

None

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 274
Patents: 179.00874 Da
Monoisotopic Mass: None
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	180.01602	138.7
[M+Na]+	201.99796	144.0
[M-H]-	178.00146	140.0
[M+NH4]+	197.04256	160.9
[M+K]+	217.97190	144.6
[M+H-H2O]+	162.00600	132.7
[M+HCOO]-	224.00694	163.5
[M+CH3COO]-	238.02259	181.9
[M+Na-2H]-	199.98341	142.8
[M]+	179.00819	138.1
[M]-	179.00929	138.1

Literature stripe

literature stripe

Patent stripe

patents stripe