CID 3021270

Brn 5497594

Structural Information

Molecular Formula
C8H16N2O
SMILES
CC(C=C)C(C(=O)N)N(C)C
InChI
InChI=1S/C8H16N2O/c1-5-6(2)7(8(9)11)10(3)4/h5-7H,1H2,2-4H3,(H2,9,11)
InChIKey
RXSZMRSPUIQQMM-UHFFFAOYSA-N
Compound name
2-(dimethylamino)-3-methylpent-4-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

156.12627 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.13355 138.2
[M+Na]+ 179.11549 142.9
[M-H]- 155.11899 139.3
[M+NH4]+ 174.16009 158.7
[M+K]+ 195.08943 143.8
[M+H-H2O]+ 139.12353 132.5
[M+HCOO]- 201.12447 160.8
[M+CH3COO]- 215.14012 188.6
[M+Na-2H]- 177.10094 138.9
[M]+ 156.12572 136.8
[M]- 156.12682 136.8
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.