1-(4-Chlorophenyl)-4,4,6-trimethyl-1,2,3,4-tetrahydropyrimidine-2-thione

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Systematic / IUPAC Name: 1-(4-Chlorophenyl)-4,4,6-trimethyl-3,4-dihydro-2(1H)-pyrimidinethione

ID: Reference6809

Other Names: 1-(4-Chlorophenyl)-2-thio-4,4,6-trimethyl dihydropyrimidine;
1-(4-Chlorophenyl)-4,4,6-trimethyl-1,4-dihydropyrimidine-2-thiol;
1-(4-Chlorophenyl)-4,4,6-trimethyl-3,4-dihydropyrimidine-2(1H)-thione;
2(1H)-Pyrimidinethione, 1-(4-chlorophenyl)-3,4-dihydro-4,4,6-trimethyl-;
2(1H)-Pyrimidinethione, 1-(p-chlorophenyl)-3,4-dihydro-4,4,6-trimethyl-

Formula: C13H15ClN2S

Spectral Data

1-(4-Chlorophenyl)-4,4,6-trimethyl-1,2,3,4-tetrahydropyrimidine-2-thione 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 9/12/2017 9:28:01 AM
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Identificators

InChI InChI=1S/C13H15ClN2S/c1-9-8-13(2,3)15-12(17)16(9)11-6-4-10(14)5-7-11/h4-8H,1-3H3,(H,15,17)
InChI Key TZQHCJOWRXAOJI-UHFFFAOYSA-N
Canonical SMILES CC1=CC(NC(=S)N1C2=CC=C(C=C2)Cl)(C)C
CAS
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Other Names 1-(4-Chlorophenyl)-2-thio-4,4,6-trimethyl dihydropyrimidine;
1-(4-Chlorophenyl)-4,4,6-trimethyl-1,4-dihydropyrimidine-2-thiol;
1-(4-Chlorophenyl)-4,4,6-trimethyl-3,4-dihydropyrimidine-2(1H)-thione;
2(1H)-Pyrimidinethione, 1-(4-chlorophenyl)-3,4-dihydro-4,4,6-trimethyl-;
2(1H)-Pyrimidinethione, 1-(p-chlorophenyl)-3,4-dihydro-4,4,6-trimethyl-;
3-(4-Chlorophenyl)-4,6,6-trimethyl-1H-pyrimidine-2-thione

In Other Databases

ChemSpider 598093
PubChem 686413
ChemIDPlus 037489488
ChEMBL CHEMBL1987191