CID 58303653

2-[(propan-2-yloxy)methyl]morpholine

Structural Information

Molecular Formula

C₈H₁₇NO₂

SMILES

CC(C)OCC1CNCCO1

InChI

InChI=1S/C8H17NO2/c1-7(2)11-6-8-5-9-3-4-10-8/h7-9H,3-6H2,1-2H3

InChIKey

SLPUHYSYZSKHFL-UHFFFAOYSA-N

Compound name

2-(propan-2-yloxymethyl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 21
Patents: 159.12593 Da
Monoisotopic Mass: 0.1
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]+	160.13321	137.1
[M+Na]+	182.11515	141.1
[M-H]-	158.11865	137.4
[M+NH4]+	177.15975	154.3
[M+K]+	198.08909	141.6
[M+H-H2O]+	142.12319	130.6
[M+HCOO]-	204.12413	153.3
[M+CH3COO]-	218.13978	174.2
[M+Na-2H]-	180.10060	141.9
[M]+	159.12538	133.8
[M]-	159.12648	133.8

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe