CID 86338125

728008-08-0

Structural Information

Molecular Formula

C₈H₁₆N₂O₂

SMILES

C1COCCN1[C@@H]2COC[C@H]2N

InChI

InChI=1S/C8H16N2O2/c9-7-5-12-6-8(7)10-1-3-11-4-2-10/h7-8H,1-6,9H2/t7-,8-/m1/s1

InChIKey

LVRARYPUYXXYIN-HTQZYQBOSA-N

Compound name

(3S,4S)-4-morpholin-4-yloxolan-3-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 19
Patents: 172.12119 Da
Monoisotopic Mass: -1.3
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]+	173.128466	138.2
[M+Na]+	195.110408	142.2
[M-H]-	171.113914	143.1
[M+NH4]+	190.155013	155.2
[M+K]+	211.084348	143.2
[M+H-H2O]+	155.118450	131.2
[M+HCOO]-	217.119391	155.6
[M+CH3COO]-	231.135041	177.9
[M+Na-2H]-	193.095856	142.1
[M]+	172.12064142	132.0
[M]-	172.12173858	132.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe