CID 71758129

850789-22-9

Structural Information

Molecular Formula

C₁₀H₁₉NO₃

SMILES

CC1(CCN1C(=O)OC(C)(C)C)CO

InChI

InChI=1S/C10H19NO3/c1-9(2,3)14-8(13)11-6-5-10(11,4)7-12/h12H,5-7H2,1-4H3

InChIKey

HDLNVUDUBFGJEM-UHFFFAOYSA-N

Compound name

tert-butyl 2-(hydroxymethyl)-2-methylazetidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 30
Patents: 201.13649 Da
Monoisotopic Mass: 0.8
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]+	202.14377	149.1
[M+Na]+	224.12571	153.3
[M+NH4]+	219.17031	152.4
[M+K]+	240.09965	150.2
[M-H]-	200.12921	144.5
[M+Na-2H]-	222.11116	150.1
[M]+	201.13594	147.1
[M]-	201.13704	147.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe