CID 51605

Fenoxycarb

Structural Information

Molecular Formula

C₁₇H₁₉NO₄

SMILES

CCOC(=O)NCCOC1=CC=C(C=C1)OC2=CC=CC=C2

InChI

InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)

InChIKey

HJUFTIJOISQSKQ-UHFFFAOYSA-N

Compound name

ethyl N-[2-(4-phenoxyphenoxy)ethyl]carbamate

Related CIDs

2D Structure

compound 2d structure

7
Annotation Hits: 193
References: 48021
Patents: 301.1314 Da
Monoisotopic Mass: 4.3
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]+	302.13868	170.9
[M+Na]+	324.12062	183.1
[M+NH4]+	319.16522	177.8
[M+K]+	340.09456	176.0
[M-H]-	300.12412	174.7
[M+Na-2H]-	322.10607	178.9
[M]+	301.13085	173.5
[M]-	301.13195	173.5

Literature stripe

literature stripe

Patent stripe

patents stripe