CID 165760673

2757961-54-7

Structural Information

Molecular Formula

C₁₃H₂₆N₂O₃

SMILES

CC1(N([C@@H](CO1)CCCN)C(=O)OC(C)(C)C)C

InChI

InChI=1S/C13H26N2O3/c1-12(2,3)18-11(16)15-10(7-6-8-14)9-17-13(15,4)5/h10H,6-9,14H2,1-5H3/t10-/m1/s1

InChIKey

COBARUFBUUGKQL-SNVBAGLBSA-N

Compound name

tert-butyl (4R)-4-(3-aminopropyl)-2,2-dimethyl-1,3-oxazolidine-3-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 258.19434 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]+	259.201616	162.4
[M+Na]+	281.183558	168.4
[M-H]-	257.187064	164.5
[M+NH4]+	276.228163	180.5
[M+K]+	297.157498	168.7
[M+H-H2O]+	241.191600	157.5
[M+HCOO]-	303.192541	179.9
[M+CH3COO]-	317.208191	197.5
[M+Na-2H]-	279.169006	164.5
[M]+	258.19379142	164.3
[M]-	258.19488858	164.3

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.