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2-(p-Toluenesulfonyloxy)-5-(phenylethynyl)benzaldehyde
SpectraBase Compound ID 7ZQcBCI6oSW
InChI InChI=1S/C22H16O4S/c1-17-7-12-21(13-8-17)27(24,25)26-22-14-11-19(15-20(22)16-23)10-9-18-5-3-2-4-6-18/h2-8,11-16H,1H3
InChIKey KWFSMNPAQDTKKV-UHFFFAOYSA-N
Mol Weight 376.43 g/mol
Molecular Formula C22H16O4S
Exact Mass 376.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F3G0UqYbGhz
Name 2-(p-Toluenesulfonyloxy)-5-(phenylethynyl)benzaldehyde
Alternate Name(s) 2-formyl-4-(phenylethynyl)phenyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16O4S
InChI InChI=1S/C22H16O4S/c1-17-7-12-21(13-8-17)27(24,25)26-22-14-11-19(15-20(22)16-23)10-9-18-5-3-2-4-6-18/h2-8,11-16H,1H3
InChIKey KWFSMNPAQDTKKV-UHFFFAOYSA-N
Molecular Weight 376.426 g/mol
SMILES c1(OS(c2ccc(cc2)C)(=O)=O)c(cc(C#Cc2ccccc2)cc1)C=O
SPLASH splash10-00fu-4797000000-5dffbb67cda9b09c73f8
Source of Spectrum QC-10-4492-5
Wiley ID 871779