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3-isopropyl-1H-2,1,3-benzothiadiazin-4(3H)-one 2,2-dioxide
SpectraBase Compound ID 9SfLQZSJXLc
InChI InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3
InChIKey ZOMSMJKLGFBRBS-UHFFFAOYSA-N
Mol Weight 240.28 g/mol
Molecular Formula C10H12N2O3S
Exact Mass 240.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8l47ZAUzaje
Name Bentazone
Source of Sample Sigma-Aldrich Cat. #32052
CAS Registry Number 25057-89-0
Classification Pesticides: Herbicides
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 240.056863425 u
Formula C10H12N2O3S
InChI InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3
InChIKey ZOMSMJKLGFBRBS-UHFFFAOYSA-N
Molecular Weight 240.277 g/mol
Number of Peaks 48
RI1 2014
SMILES N1S(N(C(c2ccccc12)=O)C(C)C)(=O)=O
SPLASH splash10-02ta-3910000000-7e359d7ce43fb81451df
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 1H-2,1,3-Benzothiadiazin-4(3H)-one, 3-(1-methylethyl)-, 2,2-dioxide
Wiley ID LM_PEST_764