CID 82385593

1779642-84-0

Structural Information

Molecular Formula

C₁₂H₂₄N₂O₃

SMILES

CC(C)(C)OC(=O)N1CCOC(C1)CCCN

InChI

InChI=1S/C12H24N2O3/c1-12(2,3)17-11(15)14-7-8-16-10(9-14)5-4-6-13/h10H,4-9,13H2,1-3H3

InChIKey

DVPLUXDEKMZVNJ-UHFFFAOYSA-N

Compound name

tert-butyl 2-(3-aminopropyl)morpholine-4-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 26
Patents: 244.1787 Da
Monoisotopic Mass: 0.6
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]+	245.18598	160.8
[M+Na]+	267.16792	164.6
[M-H]-	243.17142	162.1
[M+NH4]+	262.21252	175.2
[M+K]+	283.14186	164.9
[M+H-H2O]+	227.17596	153.9
[M+HCOO]-	289.17690	176.5
[M+CH3COO]-	303.19255	194.1
[M+Na-2H]-	265.15337	163.6
[M]+	244.17815	159.5
[M]-	244.17925	159.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe