CID 13034048

4-(3-bromopropyl)morpholine hydrobromide

Structural Information

Molecular Formula

C₇H₁₄BrNO

SMILES

C1COCCN1CCCBr

InChI

InChI=1S/C7H14BrNO/c8-2-1-3-9-4-6-10-7-5-9/h1-7H2

InChIKey

AFUWTOMPIDVMSJ-UHFFFAOYSA-N

Compound name

4-(3-bromopropyl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 230
Patents: 207.02588 Da
Monoisotopic Mass: 1.0
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]+	208.033156	139.4
[M+Na]+	230.015098	148.0
[M-H]-	206.018604	143.9
[M+NH4]+	225.059703	159.2
[M+K]+	245.989038	139.5
[M+H-H2O]+	190.023140	139.1
[M+HCOO]-	252.024081	156.1
[M+CH3COO]-	266.039731	181.7
[M+Na-2H]-	228.000546	147.5
[M]+	207.02533142	155.7
[M]-	207.02642858	155.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe