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3-(1,3-DITHIAN-2-YLIDENE)-1-ACETYL-1H-PYRAZOLE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

3-(1,3-DITHIAN-2-YLIDENE)-1-ACETYL-1H-PYRAZOLE
SpectraBase Compound ID GzB4x5cp0bc
InChI InChI=1S/C10H12N2OS2/c1-8(13)12-4-3-9(11-12)7-10-14-5-2-6-15-10/h3-4,7H,2,5-6H2,1H3
InChIKey IQIOOAKXTHUIHF-UHFFFAOYSA-N
Mol Weight 240.34 g/mol
Molecular Formula C10H12N2OS2
Exact Mass 240.039105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LNORCClFY
Name 1-[3-(1,3-dithian-2-ylidenemethyl)-1-pyrazolyl]ethanone
Alternate Name(s) 1-[3-(1,3-dithian-2-ylidenemethyl)pyrazol-1-yl]ethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12N2OS2
InChI InChI=1S/C10H12N2OS2/c1-8(13)12-4-3-9(11-12)7-10-14-5-2-6-15-10/h3-4,7H,2,5-6H2,1H3
InChIKey IQIOOAKXTHUIHF-UHFFFAOYSA-N
Molecular Weight 240.339 g/mol
SMILES c1(n[n](cc1)C(=O)C)C=C1SCCCS1
SPLASH splash10-0005-0960000000-b4d5d313d183dd35e330
Source of Spectrum PS-0-2774-17
Wiley ID 786819