CID 19856515

1142936-15-9

Structural Information

Molecular Formula

C₈H₁₄ClNO₂

SMILES

C1COCCN1CCCC(=O)Cl

InChI

InChI=1S/C8H14ClNO2/c9-8(11)2-1-3-10-4-6-12-7-5-10/h1-7H2

InChIKey

DXKAHMUXWHCNOT-UHFFFAOYSA-N

Compound name

4-morpholin-4-ylbutanoyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 191.0713 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]+	192.078576	140.6
[M+Na]+	214.060518	146.0
[M-H]-	190.064024	142.2
[M+NH4]+	209.105123	157.9
[M+K]+	230.034458	144.8
[M+H-H2O]+	174.068560	134.6
[M+HCOO]-	236.069501	153.9
[M+CH3COO]-	250.085151	179.8
[M+Na-2H]-	212.045966	145.5
[M]+	191.07075142	140.3
[M]-	191.07184858	140.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe