4-Acetyl-3-hydroxy-2-propylphenyl (dimethylamino)methanethioate

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Systematic / IUPAC Name: S-(4-Acetyl-3-hydroxy-2-propylphenyl) dimethylcarbamothioate

ID: Reference3916

Other Names: Carbamothioic acid, N,N-dimethyl, S-(4-acetyl-3-hydroxy-2-propylphenyl) ester

Formula: C14H19NO3S

Spectral Data

4-Acetyl-3-hydroxy-2-propylphenyl (dimethylamino)methanethioate 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 234
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/18/2016 7:58:26 AM
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Identificators

InChI InChI=1S/C14H19NO3S/c1-5-6-11-12(19-14(18)15(3)4)8-7-10(9(2)16)13(11)17/h7-8,17H,5-6H2,1-4H3
InChI Key TWNCYHSLYIINQX-UHFFFAOYSA-N
Canonical SMILES CCCC1=C(C=CC(=C1O)C(=O)C)SC(=O)N(C)C
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Other Names Carbamothioic acid, N,N-dimethyl, S-(4-acetyl-3-hydroxy-2-propylphenyl) ester

In Other Databases

ChemSpider 2080259
PubChem 2801555