CID 15104445

4-(2-chloropropyl)morpholine hydrochloride

Structural Information

Molecular Formula

C₇H₁₄ClNO

SMILES

CC(CN1CCOCC1)Cl

InChI

InChI=1S/C7H14ClNO/c1-7(8)6-9-2-4-10-5-3-9/h7H,2-6H2,1H3

InChIKey

DRWDYJVXXHLJLZ-UHFFFAOYSA-N

Compound name

4-(2-chloropropyl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 41
Patents: 163.07639 Da
Monoisotopic Mass: 0.9
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]+	164.083666	134.5
[M+Na]+	186.065608	140.0
[M-H]-	162.069114	136.2
[M+NH4]+	181.110213	153.0
[M+K]+	202.039548	139.2
[M+H-H2O]+	146.073650	128.7
[M+HCOO]-	208.074591	147.6
[M+CH3COO]-	222.090241	175.7
[M+Na-2H]-	184.051056	139.9
[M]+	163.07584142	133.0
[M]-	163.07693858	133.0

Literature stripe

literature stripe

Patent stripe

patents stripe