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E)-3-Benzenesulfinyl-4-[2-((E)-3-phenyl-allyloxy)-phenyl]-but-3-en-2-one
SpectraBase Compound ID GHfZw3SW2yg
InChI InChI=1S/C25H22O3S/c1-20(26)25(29(27)23-15-6-3-7-16-23)19-22-14-8-9-17-24(22)28-18-10-13-21-11-4-2-5-12-21/h2-17,19H,18H2,1H3/b13-10+,25-19+
InChIKey MVHSSHLZCXSUCO-CUQWAZQQSA-N
Mol Weight 402.51 g/mol
Molecular Formula C25H22O3S
Exact Mass 402.128966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID lJIII1AlJs
Name E)-3-Benzenesulfinyl-4-[2-((E)-3-phenyl-allyloxy)-phenyl]-but-3-en-2-one
Alternate Name(s) (3E)-4-(2-{[(2E)-3-phenyl-2-propenyl]oxy}phenyl)-3-(phenylsulfinyl)-3-buten-2-one 4-[2'-(3''-Phenyl-2''-propenyloxy)phenyl]-2-(phenylsulfinyl)-3-buten-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H22O3S
InChI InChI=1S/C25H22O3S/c1-20(26)25(29(27)23-15-6-3-7-16-23)19-22-14-8-9-17-24(22)28-18-10-13-21-11-4-2-5-12-21/h2-17,19H,18H2,1H3/b13-10+,25-19+
InChIKey MVHSSHLZCXSUCO-CUQWAZQQSA-N
Molecular Weight 402.508 g/mol
SMILES c1(S(\C(=C\c2c(OC\C=C\c3ccccc3)cccc2)C(=O)C)=O)ccccc1
SPLASH splash10-014r-0819000000-3849aeb30678db64ceb3
Source of Spectrum AH-132-398-17
Wiley ID 849908