CID 24839888

Diethylaminolactonitrile iodomethylate

Structural Information

Molecular Formula
C7H14N2O
SMILES
CCN(CC)CC(C#N)O
InChI
InChI=1S/C7H14N2O/c1-3-9(4-2)6-7(10)5-8/h7,10H,3-4,6H2,1-2H3
InChIKey
ZSXXDTMZLZFOEW-UHFFFAOYSA-N
Compound name
3-(diethylamino)-2-hydroxypropanenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

142.11061 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.11789 132.8
[M+Na]+ 165.09983 141.2
[M+NH4]+ 160.14443 136.8
[M+K]+ 181.07377 133.8
[M-H]- 141.10333 125.4
[M+Na-2H]- 163.08528 133.8
[M]+ 142.11006 130.8
[M]- 142.11116 130.8
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.