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p-TOLYL PHOSPHOROTHIOATE

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p-TOLYL PHOSPHOROTHIOATE
SpectraBase Compound ID K6S3iOzQNnH
InChI InChI=1S/C21H21O3PS/c1-16-4-10-19(11-5-16)22-25(26,23-20-12-6-17(2)7-13-20)24-21-14-8-18(3)9-15-21/h4-15H,1-3H3
InChIKey KOPAJQQYQQKYEG-UHFFFAOYSA-N
Mol Weight 384.43 g/mol
Molecular Formula C21H21O3PS
Exact Mass 384.094903 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HNl4WjukFmC
Name p-TOLYL PHOSPHOROTHIOATE
Source of Sample Eastman Organic Chemicals, Rochester, New York
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21O3PS
InChI InChI=1S/C21H21O3PS/c1-16-4-10-19(11-5-16)22-25(26,23-20-12-6-17(2)7-13-20)24-21-14-8-18(3)9-15-21/h4-15H,1-3H3
InChIKey KOPAJQQYQQKYEG-UHFFFAOYSA-N
Molecular Weight 384.44
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms PHOSPHOROTHIOIC ACID, O,O,O-TRI-P- TOLYL ESTER