CID 20480694

4-(bromomethyl)morpholine

Structural Information

Molecular Formula
C5H10BrNO
SMILES
C1COCCN1CBr
InChI
InChI=1S/C5H10BrNO/c6-5-7-1-3-8-4-2-7/h1-5H2
InChIKey
ZPICIKUVCJZBLN-UHFFFAOYSA-N
Compound name
4-(bromomethyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

178.99458 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.00186 130.2
[M+Na]+ 201.98380 139.6
[M-H]- 177.98730 135.0
[M+NH4]+ 197.02840 151.1
[M+K]+ 217.95774 131.6
[M+H-H2O]+ 161.99184 130.3
[M+HCOO]- 223.99278 147.6
[M+CH3COO]- 238.00843 176.0
[M+Na-2H]- 199.96925 139.4
[M]+ 178.99403 145.8
[M]- 178.99513 145.8
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

patents stripe