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2,2''-Sulfonyldiacetophenone

View entire compound with spectra: 1 NMR, 1 Raman, and 1 UV-Vis

2,2''-Sulfonyldiacetophenone
SpectraBase Compound ID 66CCuNZmayz
InChI InChI=1S/C16H14O4S/c17-15(13-7-3-1-4-8-13)11-21(19,20)12-16(18)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKey VXZKWVJFIXGRKM-UHFFFAOYSA-N
Mol Weight 302.34 g/mol
Molecular Formula C16H14O4S
Exact Mass 302.06128 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID CtyiTq3y4j3
Name 2,2''-Sulfonyldiacetophenone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.061280101 u
Formula C16H14O4S
InChI InChI=1S/C16H14O4S/c17-15(13-7-3-1-4-8-13)11-21(19,20)12-16(18)14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKey VXZKWVJFIXGRKM-UHFFFAOYSA-N
Molecular Weight 302.344 g/mol
SMILES C=1C(=CC=CC1)C(CS(=O)(=O)CC(C=1C=CC=CC1)=O)=O
Spectrum/Structure Validation Score (Raman) 0.992372