CID 64995835

4-(3-bromo-2-methylpropyl)morpholine hydrobromide

Structural Information

Molecular Formula
C8H16BrNO
SMILES
CC(CN1CCOCC1)CBr
InChI
InChI=1S/C8H16BrNO/c1-8(6-9)7-10-2-4-11-5-3-10/h8H,2-7H2,1H3
InChIKey
KBQXRUZLEXZYBY-UHFFFAOYSA-N
Compound name
4-(3-bromo-2-methylpropyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.04153 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.04881 144.9
[M+Na]+ 244.03075 152.7
[M-H]- 220.03425 149.2
[M+NH4]+ 239.07535 164.0
[M+K]+ 260.00469 144.3
[M+H-H2O]+ 204.03879 144.3
[M+HCOO]- 266.03973 160.3
[M+CH3COO]- 280.05538 185.2
[M+Na-2H]- 242.01620 151.1
[M]+ 221.04098 160.8
[M]- 221.04208 160.8
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.