N-(3-Methoxypropyl)-N'-[3-(methylthio)phenyl]thiourea

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Systematic / IUPAC Name: 1-(3-Methoxypropyl)-3-[3-(methylsulfanyl)phenyl]thiourea

ID: Reference6791

Other Names: N-(3-Methoxypropyl)-N'-[3-(methylthio)phenyl]thiourea ;
Thiourea, N-(3-methoxypropyl)-N'-[3-(methylthio)phenyl]-

Formula: C12H18N2OS2

Spectral Data

N-(3-Methoxypropyl)-N'-[3-(methylthio)phenyl]thiourea 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 238
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 9/6/2017 9:20:16 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C12H18N2OS2/c1-15-8-4-7-13-12(16)14-10-5-3-6-11(9-10)17-2/h3,5-6,9H,4,7-8H2,1-2H3,(H2,13,14,16)
InChI Key ZMRKWWGSTJDZNQ-UHFFFAOYSA-N
Canonical SMILES COCCCNC(=S)NC1=CC(=CC=C1)SC
CAS
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Other Names N-(3-Methoxypropyl)-N'-[3-(methylthio)phenyl]thiourea ;
Thiourea, N-(3-methoxypropyl)-N'-[3-(methylthio)phenyl]-

In Other Databases

ChEMBL CHEMBL1558995
ChemSpider 2007243
PubChem 2725136