CID 49514

Dtxsid30986267

Structural Information

Molecular Formula

C₁₅H₂₂N₂O₂

SMILES

C1CCC(CC1)NCCOC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C15H22N2O2/c18-15(17-14-9-5-2-6-10-14)19-12-11-16-13-7-3-1-4-8-13/h2,5-6,9-10,13,16H,1,3-4,7-8,11-12H2,(H,17,18)

InChIKey

QXBFUCHAIXNTHG-UHFFFAOYSA-N

Compound name

2-(cyclohexylamino)ethyl N-phenylcarbamate

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 1
Patents: 262.16812 Da
Monoisotopic Mass: 3.3
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]+	263.17540	161.0
[M+Na]+	285.15734	162.2
[M-H]-	261.16084	165.8
[M+NH4]+	280.20194	176.0
[M+K]+	301.13128	159.7
[M+H-H2O]+	245.16538	152.4
[M+HCOO]-	307.16632	182.4
[M+CH3COO]-	321.18197	198.8
[M+Na-2H]-	283.14279	165.1
[M]+	262.16757	156.0
[M]-	262.16867	156.0

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.