CID 10921066

2-bromo-n,n-dimethylprop-2-enamide

Structural Information

Molecular Formula
C5H8BrNO
SMILES
CN(C)C(=O)C(=C)Br
InChI
InChI=1S/C5H8BrNO/c1-4(6)5(8)7(2)3/h1H2,2-3H3
InChIKey
JNGAAMQFKFDZJD-UHFFFAOYSA-N
Compound name
2-bromo-N,N-dimethylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

176.97893 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.98621 129.3
[M+Na]+ 199.96815 139.9
[M-H]- 175.97165 134.0
[M+NH4]+ 195.01275 153.1
[M+K]+ 215.94209 131.1
[M+H-H2O]+ 159.97619 129.4
[M+HCOO]- 221.97713 150.9
[M+CH3COO]- 235.99278 184.1
[M+Na-2H]- 197.95360 135.0
[M]+ 176.97838 147.5
[M]- 176.97948 147.5
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