CID 3087034

65347-85-5

Structural Information

Molecular Formula

C₁₇H₂₆N₂O₄

SMILES

CCCCOC1=CC=CC=C1NC(=O)OCCN2CCOCC2

InChI

InChI=1S/C17H26N2O4/c1-2-3-11-22-16-7-5-4-6-15(16)18-17(20)23-14-10-19-8-12-21-13-9-19/h4-7H,2-3,8-14H2,1H3,(H,18,20)

InChIKey

CUQGZNNSUMPQIX-UHFFFAOYSA-N

Compound name

2-morpholin-4-ylethyl N-(2-butoxyphenyl)carbamate

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 0
Patents: 322.18927 Da
Monoisotopic Mass: 2.4
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]+	323.196546	178.1
[M+Na]+	345.178488	180.2
[M-H]-	321.181994	182.2
[M+NH4]+	340.223093	188.6
[M+K]+	361.152428	179.1
[M+H-H2O]+	305.186530	168.2
[M+HCOO]-	367.187471	195.9
[M+CH3COO]-	381.203121	207.8
[M+Na-2H]-	343.163936	181.0
[M]+	322.18872142	178.9
[M]-	322.18981858	178.9

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.