CID 10977653

(2r)-1-morpholino-2-((tetrahydro-2h-pyran-2-yl)oxy)propan-1-one

Structural Information

Molecular Formula

C₁₂H₂₁NO₄

SMILES

C[C@H](C(=O)N1CCOCC1)OC2CCCCO2

InChI

InChI=1S/C12H21NO4/c1-10(17-11-4-2-3-7-16-11)12(14)13-5-8-15-9-6-13/h10-11H,2-9H2,1H3/t10-,11?/m1/s1

InChIKey

ANFZGSBFEPFDNR-NFJWQWPMSA-N

Compound name

(2R)-1-morpholin-4-yl-2-(oxan-2-yloxy)propan-1-one

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 70
Patents: 243.14706 Da
Monoisotopic Mass: 0.5
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]+	244.154336	157.2
[M+Na]+	266.136278	158.2
[M-H]-	242.139784	161.6
[M+NH4]+	261.180883	169.4
[M+K]+	282.110218	160.4
[M+H-H2O]+	226.144320	148.9
[M+HCOO]-	288.145261	169.4
[M+CH3COO]-	302.160911	189.7
[M+Na-2H]-	264.121726	159.5
[M]+	243.14651142	152.4
[M]-	243.14760858	152.4

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe