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3-Benzoyl-4-(n-propyl)-1,2,5-thiadiazole

View entire compound with spectra: 1 MS (GC)

3-Benzoyl-4-(n-propyl)-1,2,5-thiadiazole
SpectraBase Compound ID 22SPHR9s9nk
InChI InChI=1S/C12H12N2OS/c1-2-6-10-11(14-16-13-10)12(15)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3
InChIKey DYAYFDTVDRCFEX-UHFFFAOYSA-N
Mol Weight 232.3 g/mol
Molecular Formula C12H12N2OS
Exact Mass 232.067034 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6xT1sZZnLCX
Name 3-Benzoyl-4-(n-propyl)-1,2,5-thiadiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2OS
InChI InChI=1S/C12H12N2OS/c1-2-6-10-11(14-16-13-10)12(15)9-7-4-3-5-8-9/h3-5,7-8H,2,6H2,1H3
InChIKey DYAYFDTVDRCFEX-UHFFFAOYSA-N
Molecular Weight 232.301 g/mol
SMILES c1(nsnc1CCC)C(=O)c1ccccc1
SPLASH splash10-0udi-2290000000-781c1048f707f286ace1
Source of Spectrum H1-53-170-3
Synonyms phenyl(4-propyl-1,2,5-thiadiazol-3-yl)methanone
Wiley ID 817736