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: 1178
Patents: 193.01022 Da
Monoisotopic Mass: 0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	194.01750	134.8
[M+Na]+	215.99944	143.8
[M-H]-	192.00294	139.5
[M+NH4]+	211.04404	155.1
[M+K]+	231.97338	135.5
[M+H-H2O]+	176.00748	134.7
[M+HCOO]-	238.00842	151.8
[M+CH3COO]-	252.02407	178.8
[M+Na-2H]-	213.98489	143.4
[M]+	193.00967	150.7
[M]-	193.01077	150.7

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.