CID 1502101

4-(2-bromoethyl)morpholine

Structural Information

Molecular Formula
C6H12BrNO
SMILES
C1COCCN1CCBr
InChI
InChI=1S/C6H12BrNO/c7-1-2-8-3-5-9-6-4-8/h1-6H2
InChIKey
CVMXEDZZSWLXPB-UHFFFAOYSA-N
Compound name
4-(2-bromoethyl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1201
Patents

193.01022 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.017496 134.8
[M+Na]+ 215.999438 143.8
[M-H]- 192.002944 139.5
[M+NH4]+ 211.044043 155.1
[M+K]+ 231.973378 135.5
[M+H-H2O]+ 176.007480 134.7
[M+HCOO]- 238.008421 151.8
[M+CH3COO]- 252.024071 178.8
[M+Na-2H]- 213.984886 143.4
[M]+ 193.00967142 150.7
[M]- 193.01076858 150.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe