CID 379613

Nsc664319

Structural Information

Molecular Formula
C12H26O4Se
SMILES
CCOC(C[Se]CC(OCC)OCC)OCC
InChI
InChI=1S/C12H26O4Se/c1-5-13-11(14-6-2)9-17-10-12(15-7-3)16-8-4/h11-12H,5-10H2,1-4H3
InChIKey
SFSJOFBVBORGMJ-UHFFFAOYSA-N
Compound name
2-(2,2-diethoxyethylselanyl)-1,1-diethoxyethane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.09964 Da
Monoisotopic Mass

None
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.10692 176.3
[M+Na]+ 337.08886 179.6
[M-H]- 313.09236 174.8
[M+NH4]+ 332.13346 192.9
[M+K]+ 353.06280 180.0
[M+H-H2O]+ 297.09690 169.3
[M+HCOO]- 359.09784 196.0
[M+CH3COO]- 373.11349 200.0
[M+Na-2H]- 335.07431 175.8
[M]+ 314.09909 184.8
[M]- 314.10019 184.8
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.