CID 15742132

139115-92-7

Structural Information

Molecular Formula

C₁₁H₂₃NO₅

SMILES

CC(C)(C)OC(=O)NCCOCCOCCO

InChI

InChI=1S/C11H23NO5/c1-11(2,3)17-10(14)12-4-6-15-8-9-16-7-5-13/h13H,4-9H2,1-3H3,(H,12,14)

InChIKey

FMLOTGGIHAYZLW-UHFFFAOYSA-N

Compound name

tert-butyl N-[2-[2-(2-hydroxyethoxy)ethoxy]ethyl]carbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 522
Patents: 249.15762 Da
Monoisotopic Mass: -0.1
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]+	250.16490	158.4
[M+Na]+	272.14684	164.2
[M+NH4]+	267.19144	162.6
[M+K]+	288.12078	161.5
[M-H]-	248.15034	154.8
[M+Na-2H]-	270.13229	158.5
[M]+	249.15707	157.6
[M]-	249.15817	157.6

Literature stripe

literature stripe

Patent stripe

patents stripe