CID 132343841

3-[(oxolan-3-yl)methyl]morpholine

Structural Information

Molecular Formula

C₉H₁₇NO₂

SMILES

C1COCC1CC2COCCN2

InChI

InChI=1S/C9H17NO2/c1-3-11-6-8(1)5-9-7-12-4-2-10-9/h8-10H,1-7H2

InChIKey

YQPVVNOZTVENQF-UHFFFAOYSA-N

Compound name

3-(oxolan-3-ylmethyl)morpholine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 171.12593 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]+	172.133206	138.7
[M+Na]+	194.115148	141.8
[M-H]-	170.118654	142.3
[M+NH4]+	189.159753	155.3
[M+K]+	210.089088	142.3
[M+H-H2O]+	154.123190	132.0
[M+HCOO]-	216.124131	153.9
[M+CH3COO]-	230.139781	173.0
[M+Na-2H]-	192.100596	142.9
[M]+	171.12538142	132.3
[M]-	171.12647858	132.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.