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2-[(2,4,6-Triisopropylphenyl)sulfinyl]acetophenone
SpectraBase Compound ID jcZUrGQjFJ
InChI InChI=1S/C23H30O2S/c1-14(2)18-12-20(15(3)4)23(21(13-18)16(5)6)26(25)22-11-9-8-10-19(22)17(7)24/h8-16H,1-7H3
InChIKey MFPJYGDSSJWWJG-UHFFFAOYSA-N
Mol Weight 370.55 g/mol
Molecular Formula C23H30O2S
Exact Mass 370.196651 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID EwrrP6LDfK3
Name 2-[(2,4,6-Triisopropylphenyl)sulfinyl]acetophenone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 370.196651378 u
Formula C23H30O2S
InChI InChI=1S/C23H30O2S/c1-14(2)18-12-20(15(3)4)23(21(13-18)16(5)6)26(25)22-11-9-8-10-19(22)17(7)24/h8-16H,1-7H3
InChIKey MFPJYGDSSJWWJG-UHFFFAOYSA-N
Molecular Weight 370.551 g/mol
SMILES C1(S(C2=C(C(=O)C)C=CC=C2)=O)=C(C=C(C=C1C(C)C)C(C)C)C(C)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.947482