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5-Methoxy-1-(phenylsulfonyl)-1,3-cyclohexadiene
SpectraBase Compound ID CzHrjrPOv2c
InChI InChI=1S/C13H14O3S/c1-16-11-6-5-9-13(10-11)17(14,15)12-7-3-2-4-8-12/h2-9,11H,10H2,1H3
InChIKey HXROKSQHQGFUSV-UHFFFAOYSA-N
Mol Weight 250.31 g/mol
Molecular Formula C13H14O3S
Exact Mass 250.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8yRsnmtWCEQ
Name 5-Methoxy-1-(phenylsulfonyl)-1,3-cyclohexadiene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O3S
InChI InChI=1S/C13H14O3S/c1-16-11-6-5-9-13(10-11)17(14,15)12-7-3-2-4-8-12/h2-9,11H,10H2,1H3
InChIKey HXROKSQHQGFUSV-UHFFFAOYSA-N
Molecular Weight 250.312 g/mol
SMILES C=1(S(=O)(=O)c2ccccc2)CC(OC)C=CC1
SPLASH splash10-004j-7790000000-98330c9662dd668f8906
Source of Spectrum QA-44-369-8a
Synonyms (5-methoxy-1-cyclohexa-1,3-dienyl)sulfonylbenzene
Wiley ID 862568