N1-{5-[(Cyanomethyl)thio]-1,3,4-thiadiazol-2-yl}acetamide

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Systematic / IUPAC Name: N-{5-[(Cyanomethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}acetamide

ID: Reference4295

Other Names: Acetamide, N-{5-[(cyanomethyl)thio]-1,3,4-thiadiazol-2-yl}-

Formula: C6H6N4OS2

Spectral Data

N1-{5-[(Cyanomethyl)thio]-1,3,4-thiadiazol-2-yl}acetamide 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 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 3/18/2016 2:01:16 PM
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Identificators

InChI InChI=1S/C6H6N4OS2/c1-4(11)8-5-9-10-6(13-5)12-3-2-7/h3H2,1H3,(H,8,9,11)
InChI Key OSGVBEVJCNQOAU-UHFFFAOYSA-N
Canonical SMILES CC(=O)NC1=NN=C(S1)SCC#N
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Other Names Acetamide, N-{5-[(cyanomethyl)thio]-1,3,4-thiadiazol-2-yl}-

In Other Databases

ChemSpider 2079253
PubChem 2800528