CID 90358615

1393732-56-3

Structural Information

Molecular Formula

C₁₀H₁₉NO₄

SMILES

CC(C)(C)OC(=O)N1CC(C1)C(CO)O

InChI

InChI=1S/C10H19NO4/c1-10(2,3)15-9(14)11-4-7(5-11)8(13)6-12/h7-8,12-13H,4-6H2,1-3H3

InChIKey

RTZOSQFRADBDJU-UHFFFAOYSA-N

Compound name

tert-butyl 3-(1,2-dihydroxyethyl)azetidine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 217.13141 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]+	218.13869	153.1
[M+Na]+	240.12063	156.7
[M-H]-	216.12413	152.2
[M+NH4]+	235.16523	162.5
[M+K]+	256.09457	159.5
[M+H-H2O]+	200.12867	142.2
[M+HCOO]-	262.12961	167.0
[M+CH3COO]-	276.14526	186.4
[M+Na-2H]-	238.10608	154.0
[M]+	217.13086	161.5
[M]-	217.13196	161.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe