CID 5875495

149139-41-3

Structural Information

Molecular Formula
C6H8N2O
SMILES
CN(C)/C=C(/C=O)\C#N
InChI
InChI=1S/C6H8N2O/c1-8(2)4-6(3-7)5-9/h4-5H,1-2H3/b6-4+
InChIKey
RRUXUDNMISMLAO-GQCTYLIASA-N
Compound name
(E)-3-(dimethylamino)-2-formylprop-2-enenitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

25
Patents

124.06366 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 125.07094 125.6
[M+Na]+ 147.05288 134.2
[M-H]- 123.05638 127.8
[M+NH4]+ 142.09748 145.9
[M+K]+ 163.02682 134.7
[M+H-H2O]+ 107.06092 114.1
[M+HCOO]- 169.06186 146.9
[M+CH3COO]- 183.07751 189.8
[M+Na-2H]- 145.03833 130.7
[M]+ 124.06311 121.6
[M]- 124.06421 121.6
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.