5-Butyl-2-(4-chlorophenyl)-6-(methoxymethyl)pyrimidin-4-ol

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Systematic / IUPAC Name: 5-Butyl-2-(4-chlorophenyl)-6-(methoxymethyl)-4(1H)-pyrimidinone

ID: Reference6056

Other Names: 4(1H)-Pyrimidinone, 5-butyl-2-(4-chlorophenyl)-6-(methoxymethyl)-

Formula: C16H19ClN2O2

Spectral Data

5-Butyl-2-(4-chlorophenyl)-6-(methoxymethyl)pyrimidin-4-ol 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 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/22/2016 6:35:51 AM
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Identificators

InChI InChI=1S/C16H19ClN2O2/c1-3-4-5-13-14(10-21-2)18-15(19-16(13)20)11-6-8-12(17)9-7-11/h6-9H,3-5,10H2,1-2H3,(H,18,19,20)
InChI Key OQPFUQVQSWUATL-UHFFFAOYSA-N
Canonical SMILES CCCCC1=C(NC(=NC1=O)C2=CC=C(C=C2)Cl)COC
CAS
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Other Names 4(1H)-Pyrimidinone, 5-butyl-2-(4-chlorophenyl)-6-(methoxymethyl)-

In Other Databases

PubChem 2730497
ChemSpider 2012419