CID 12331083

4-(chloromethyl)morpholine hydrochloride

Structural Information

Molecular Formula

C₅H₁₀ClNO

SMILES

C1COCCN1CCl

InChI

InChI=1S/C5H10ClNO/c6-5-7-1-3-8-4-2-7/h1-5H2

InChIKey

FXAHCXPEXLCFFY-UHFFFAOYSA-N

Compound name

4-(chloromethyl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 58
Patents: 135.04509 Da
Monoisotopic Mass: 0.6
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]+	136.05237	125.0
[M+Na]+	158.03431	131.6
[M-H]-	134.03781	126.9
[M+NH4]+	153.07891	144.7
[M+K]+	174.00825	130.9
[M+H-H2O]+	118.04235	119.5
[M+HCOO]-	180.04329	139.8
[M+CH3COO]-	194.05894	168.8
[M+Na-2H]-	156.01976	132.7
[M]+	135.04454	123.4
[M]-	135.04564	123.4

Literature stripe

literature stripe

Patent stripe

patents stripe