N1-Acetyl-2-{[3-(acetylamino)-3-oxopropyl]thio}benzamide

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Systematic / IUPAC Name: 2-[(3-Acetamido-3-oxopropyl)sulfanyl]-N-acetylbenzamide

ID: Reference8717

Other Names: Benzamide, N-acetyl-2-[[3-(acetylamino)-3-oxopropyl]thio]-

Formula: C14H16N2O4S

Spectral Data

N1-Acetyl-2-{[3-(acetylamino)-3-oxopropyl]thio}benzamide 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 110
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/8/2019 11:52:01 AM
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Identificators

InChI InChI=1S/C14H16N2O4S/c1-9(17)15-13(19)7-8-21-12-6-4-3-5-11(12)14(20)16-10(2)18/h3-6H,7-8H2,1-2H3,(H,15,17,19)(H,16,18,20)
InChI Key DJALIOOHHCVQKU-UHFFFAOYSA-N
Canonical SMILES CC(=O)NC(=O)CCSC1=CC=CC=C1C(=O)NC(=O)C
CAS
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Other Names Benzamide, N-acetyl-2-[[3-(acetylamino)-3-oxopropyl]thio]-

In Other Databases

ChemSpider 2080633
PubChem 2801937