CID 53417644

4-(2-bromoethyl)-2,6-dimethylmorpholine hydrobromide

Structural Information

Molecular Formula
C8H16BrNO
SMILES
CC1CN(CC(O1)C)CCBr
InChI
InChI=1S/C8H16BrNO/c1-7-5-10(4-3-9)6-8(2)11-7/h7-8H,3-6H2,1-2H3
InChIKey
FZUMZQZVVFIUOM-UHFFFAOYSA-N
Compound name
4-(2-bromoethyl)-2,6-dimethylmorpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.04153 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.048806 143.3
[M+Na]+ 244.030748 153.2
[M-H]- 220.034254 148.4
[M+NH4]+ 239.075353 163.2
[M+K]+ 260.004688 144.4
[M+H-H2O]+ 204.038790 143.1
[M+HCOO]- 266.039731 159.7
[M+CH3COO]- 280.055381 186.6
[M+Na-2H]- 242.016196 149.5
[M]+ 221.04098142 160.6
[M]- 221.04207858 160.6
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.