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4-chloro-2,5-xylenesulfonic acid, p-(benzyloxy)phenyl ester
SpectraBase Compound ID 27wRo1jJ7HL
InChI InChI=1S/C21H19ClO4S/c1-15-13-21(16(2)12-20(15)22)27(23,24)26-19-10-8-18(9-11-19)25-14-17-6-4-3-5-7-17/h3-13H,14H2,1-2H3
InChIKey DBWUWLAEYJBMAE-UHFFFAOYSA-N
Mol Weight 402.89 g/mol
Molecular Formula C21H19ClO4S
Exact Mass 402.069258 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 68kBNmoAlRf
Name 4-chloro-2,5-xylenesulfonic acid, p-(benzyloxy)phenyl ester
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19ClO4S
InChI InChI=1S/C21H19ClO4S/c1-15-13-21(16(2)12-20(15)22)27(23,24)26-19-10-8-18(9-11-19)25-14-17-6-4-3-5-7-17/h3-13H,14H2,1-2H3
InChIKey DBWUWLAEYJBMAE-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 48355M
Solvent CDCl3