CID 46173391

Structural Information

Molecular Formula
C6H14NO2Se
SMILES
C[Se](C)CCC(C(=O)O)N
InChI
InChI=1S/C6H14NO2Se/c1-10(2)4-3-5(7)6(8)9/h5H,3-4,7H2,1-2H3,(H,8,9)
InChIKey
WHJRAUIUPCDSHZ-UHFFFAOYSA-N
Compound name
None
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

2
Patents

212.01898 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.02626 143.1
[M+Na]+ 235.00820 150.1
[M+NH4]+ 230.05280 149.2
[M+K]+ 250.98214 146.7
[M-H]- 211.01170 141.1
[M+Na-2H]- 232.99365 143.6
[M]+ 212.01843 142.9
[M]- 212.01953 142.9
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

patents stripe