CID 3064432

N-(2-bromoallyl)propionamide

Structural Information

Molecular Formula
C6H10BrNO
SMILES
CCC(=O)NCC(=C)Br
InChI
InChI=1S/C6H10BrNO/c1-3-6(9)8-4-5(2)7/h2-4H2,1H3,(H,8,9)
InChIKey
WWZPICKFNYFROH-UHFFFAOYSA-N
Compound name
N-(2-bromoprop-2-enyl)propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

190.99458 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.00186 134.0
[M+Na]+ 213.98380 134.3
[M+NH4]+ 209.02840 137.9
[M+K]+ 229.95774 135.6
[M-H]- 189.98730 132.2
[M+Na-2H]- 211.96925 134.6
[M]+ 190.99403 132.0
[M]- 190.99513 132.0
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.