CID 146155371

2416243-46-2

Structural Information

Molecular Formula

C₁₄H₂₆N₂O₃

SMILES

CC(C)(C)OC(=O)N1CCC2(CC1)C(CC2OC)N

InChI

InChI=1S/C14H26N2O3/c1-13(2,3)19-12(17)16-7-5-14(6-8-16)10(15)9-11(14)18-4/h10-11H,5-9,15H2,1-4H3

InChIKey

GROPMVKRJSPXHA-UHFFFAOYSA-N

Compound name

tert-butyl 1-amino-3-methoxy-7-azaspiro[3.5]nonane-7-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 270.19434 Da
Monoisotopic Mass: 0.9
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]+	271.201616	166.6
[M+Na]+	293.183558	169.7
[M-H]-	269.187064	169.4
[M+NH4]+	288.228163	177.2
[M+K]+	309.157498	172.1
[M+H-H2O]+	253.191600	155.4
[M+HCOO]-	315.192541	180.5
[M+CH3COO]-	329.208191	202.2
[M+Na-2H]-	291.169006	168.0
[M]+	270.19379142	172.5
[M]-	270.19488858	172.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.