CID 117617

4-decylmorpholine

Structural Information

Molecular Formula

C₁₄H₂₉NO

SMILES

CCCCCCCCCCN1CCOCC1

InChI

InChI=1S/C14H29NO/c1-2-3-4-5-6-7-8-9-10-15-11-13-16-14-12-15/h2-14H2,1H3

InChIKey

KAXVRMIUQJXONY-UHFFFAOYSA-N

Compound name

4-decylmorpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 239
Patents: 227.22491 Da
Monoisotopic Mass: 4.4
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]+	228.23219	160.3
[M+Na]+	250.21413	162.5
[M-H]-	226.21763	160.8
[M+NH4]+	245.25873	175.5
[M+K]+	266.18807	161.4
[M+H-H2O]+	210.22217	152.4
[M+HCOO]-	272.22311	176.8
[M+CH3COO]-	286.23876	192.2
[M+Na-2H]-	248.19958	163.6
[M]+	227.22436	160.2
[M]-	227.22546	160.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.