CID 81161221

2195367-28-1

Structural Information

Molecular Formula

C₈H₁₅NO₂

SMILES

CC(C)OC(=O)C1(CCC1)N

InChI

InChI=1S/C8H15NO2/c1-6(2)11-7(10)8(9)4-3-5-8/h6H,3-5,9H2,1-2H3

InChIKey

RNIKDGJUHFZZPQ-UHFFFAOYSA-N

Compound name

propan-2-yl 1-aminocyclobutane-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 16
Patents: 157.11028 Da
Monoisotopic Mass: 0.7
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]+	158.117556	138.9
[M+Na]+	180.099498	143.0
[M-H]-	156.103004	141.8
[M+NH4]+	175.144103	154.4
[M+K]+	196.073438	146.3
[M+H-H2O]+	140.107540	129.2
[M+HCOO]-	202.108481	159.1
[M+CH3COO]-	216.124131	182.4
[M+Na-2H]-	178.084946	141.9
[M]+	157.10973142	145.7
[M]-	157.11082858	145.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe