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4,6-bis(Phenylsulfonyl)-m-xylene
SpectraBase Compound ID 7IxC6ZQLsfQ
InChI InChI=1S/C20H18O4S2/c1-15-13-16(2)20(26(23,24)18-11-7-4-8-12-18)14-19(15)25(21,22)17-9-5-3-6-10-17/h3-14H,1-2H3
InChIKey UNWWROCAZJJOEG-UHFFFAOYSA-N
Mol Weight 386.48 g/mol
Molecular Formula C20H18O4S2
Exact Mass 386.064651 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID 9Be33S1Twgg
Name 4,6-bis(Phenylsulfonyl)-m-xylene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 386.064651404 u
Formula C20H18O4S2
InChI InChI=1S/C20H18O4S2/c1-15-13-16(2)20(26(23,24)18-11-7-4-8-12-18)14-19(15)25(21,22)17-9-5-3-6-10-17/h3-14H,1-2H3
InChIKey UNWWROCAZJJOEG-UHFFFAOYSA-N
Molecular Weight 386.480 g/mol
SMILES C1=CC=C(S(C=2C(C)=CC(C)=C(C2)S(=O)(=O)C=2C=CC=CC2)(=O)=O)C=C1
Spectrum/Structure Validation Score (Raman) 0.947434