CID 735736

77279-24-4

Structural Information

Molecular Formula

C₁₁H₂₂N₂O₃

SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CCO

InChI

InChI=1S/C11H22N2O3/c1-11(2,3)16-10(15)13-6-4-12(5-7-13)8-9-14/h14H,4-9H2,1-3H3

InChIKey

VRXIOAYUQIITBU-UHFFFAOYSA-N

Compound name

tert-butyl 4-(2-hydroxyethyl)piperazine-1-carboxylate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1328
Patents: 230.16304 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]+	231.17032	155.2
[M+Na]+	253.15226	163.3
[M+NH4]+	248.19686	160.5
[M+K]+	269.12620	159.9
[M-H]-	229.15576	153.1
[M+Na-2H]-	251.13771	157.0
[M]+	230.16249	155.3
[M]-	230.16359	155.3

Literature stripe

literature stripe

Patent stripe

patents stripe