CID 146075376

3-[amino(cyclopropyl)methyl]oxetan-3-ol

Structural Information

Molecular Formula

C₇H₁₃NO₂

SMILES

C1CC1C(C2(COC2)O)N

InChI

InChI=1S/C7H13NO2/c8-6(5-1-2-5)7(9)3-10-4-7/h5-6,9H,1-4,8H2

InChIKey

OVRVPJDKUQAXMK-UHFFFAOYSA-N

Compound name

3-[amino(cyclopropyl)methyl]oxetan-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 143.09464 Da
Monoisotopic Mass: -1.1
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]+	144.10192	133.3
[M+Na]+	166.08386	139.5
[M+NH4]+	161.12846	139.4
[M+K]+	182.05780	137.4
[M-H]-	142.08736	140.5
[M+Na-2H]-	164.06931	139.0
[M]+	143.09409	136.1
[M]-	143.09519	136.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe