N-(1-Adamantyl)-N'-[2-(methylthio)benzyl]urea

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Systematic / IUPAC Name: 1-Adamantan-1-yl-3-[2-(methylsulfanyl)benzyl]urea

ID: Reference4120

Other Names: N-(1-Adamantyl)-N'-[2-(methylthio)benzyl]urea ;
Urea, N-{[2-(methylthio)phenyl]methyl}-N'-tricyclo[3.3.1.13,7]dec-1-yl-

Formula: C19H26N2OS

Spectral Data

N-(1-Adamantyl)-N'-[2-(methylthio)benzyl]urea 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 Orbitrap
No. of Spectral Trees 2
No. of Spectra 184
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/9/2016 12:49:40 PM
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Identificators

InChI InChI=1S/C19H26N2OS/c1-23-17-5-3-2-4-16(17)12-20-18(22)21-19-9-13-6-14(10-19)8-15(7-13)11-19/h2-5,13-15H,6-12H2,1H3,(H2,20,21,22)
InChI Key WPXRUUMUUGRZGQ-UHFFFAOYSA-N
Canonical SMILES CSC1=CC=CC=C1CNC(=O)NC23CC4CC(C2)CC(C4)C3
CAS
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Other Names N-(1-Adamantyl)-N'-[2-(methylthio)benzyl]urea ;
Urea, N-{[2-(methylthio)phenyl]methyl}-N'-tricyclo[3.3.1.13,7]dec-1-yl-

In Other Databases

ChemSpider 2101461
PubChem 2823249