URB937

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Systematic / IUPAC Name: [3-(3-Carbamoylphenyl)-4-hydroxyphenyl] N-cyclohexylcarbamate

ID: Reference5004

Other Names: 3'-Carbamoyl-6-hydroxybiphenyl-3-yl cyclohexylcarbamate;
Carbamic acid, N-cyclohexyl, 3'-(aminocarbonyl)-6-hydroxy[1,1'-biphenyl]-3-yl ester

Formula: C20H22N2O4

Class: Sports Doping Drugs Drugs of Abuse/Illegal Drugs

Spectral Data

URB937 mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 203
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 6/14/2016 1:31:29 PM
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Identificators

InChI InChI=1S/C20H22N2O4/c21-19(24)14-6-4-5-13(11-14)17-12-16(9-10-18(17)23)26-20(25)22-15-7-2-1-3-8-15/h4-6,9-12,15,23H,1-3,7-8H2,(H2,21,24)(H,22,25)
InChI Key CMEQHOXCIGFZNJ-UHFFFAOYSA-N
Canonical SMILES C1CCC(CC1)NC(=O)OC2=CC(=C(C=C2)O)C3=CC(=CC=C3)C(=O)N
CAS 1357160725
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Other Names 3'-Carbamoyl-6-hydroxybiphenyl-3-yl cyclohexylcarbamate;
Carbamic acid, N-cyclohexyl, 3'-(aminocarbonyl)-6-hydroxy[1,1'-biphenyl]-3-yl ester

In Other Databases

ChemSpider 26458662
PubChem 53394762
ChEMBL CHEMBL2402927