CID 80495260

1522173-21-2

Structural Information

Molecular Formula

C₈H₁₃NO₃

SMILES

COC(=O)C1(COC1)NC2CC2

InChI

InChI=1S/C8H13NO3/c1-11-7(10)8(4-12-5-8)9-6-2-3-6/h6,9H,2-5H2,1H3

InChIKey

INVSIQHNSZEHGO-UHFFFAOYSA-N

Compound name

methyl 3-(cyclopropylamino)oxetane-3-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 171.08954 Da
Monoisotopic Mass: -0.2
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]+	172.09682	140.1
[M+Na]+	194.07876	146.5
[M+NH4]+	189.12336	145.7
[M+K]+	210.05270	144.0
[M-H]-	170.08226	147.3
[M+Na-2H]-	192.06421	146.0
[M]+	171.08899	142.9
[M]-	171.09009	142.9

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.