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Benzothiazole, 3-ethyl-2,3-dihydro-2-[3-(phenylsulfonyl)-3-[(trifluoromethyl)sulfonyl]-2-propen-1-ylidene]-
SpectraBase Compound ID JMcL9nbaRnT
InChI InChI=1S/C19H16F3NO4S3/c1-2-23-15-10-6-7-11-16(15)28-17(23)12-13-18(30(26,27)19(20,21)22)29(24,25)14-8-4-3-5-9-14/h3-13H,2H2,1H3/b17-12-,18-13-
InChIKey HLYZIAJNJDZHHB-MZGHLJKDSA-N
Mol Weight 475.52 g/mol
Molecular Formula C19H16F3NO4S3
Exact Mass 475.019356 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34fRBJq0F8R
Name Benzothiazole, 3-ethyl-2,3-dihydro-2-[3-(phenylsulfonyl)-3-[(trifluoromethyl)sulfonyl]-2-propen-1-ylidene]-
Alternate Name(s) 3-Ethyl-2-(3-(phenylsulfonyl)-3-((trifluoromethyl)sulfonyl)allylidene)-2,3-dihydrobenzo[d]thiazole 2-[3-(benzenesulfonyl)-3-(trifluoromethylsulfonyl)prop-2-enylidene]-3-ethyl-1,3-benzothiazole 3-Ethyl-2-[3-(phenylsulfonyl)-3-(trifluoromethylsulfonyl)prop-2-enylidene]-1,3-benzothiazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16F3NO4S3
InChI InChI=1S/C19H16F3NO4S3/c1-2-23-15-10-6-7-11-16(15)28-17(23)12-13-18(30(26,27)19(20,21)22)29(24,25)14-8-4-3-5-9-14/h3-13H,2H2,1H3/b17-12-,18-13-
InChIKey HLYZIAJNJDZHHB-MZGHLJKDSA-N
Molecular Weight 475.515 g/mol
SMILES CCN1\C(Sc2ccccc12)=C\C=C\(S(=O)(=O)c1ccccc1)S(=O)(=O)C(F)(F)F
SPLASH splash10-0v09-3961500000-9b6b09402f265832dca5
Source of Spectrum JX-2015-4-807
Wiley ID 1726223