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1-(4-Methylphenyl)sulfonylhex-5-en-2-ol
SpectraBase Compound ID hR0xXb976e
InChI InChI=1S/C13H18O3S/c1-3-4-5-12(14)10-17(15,16)13-8-6-11(2)7-9-13/h3,6-9,12,14H,1,4-5,10H2,2H3
InChIKey ANGOWJLOHLJYTI-UHFFFAOYSA-N
Mol Weight 254.34 g/mol
Molecular Formula C13H18O3S
Exact Mass 254.097666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CmMETwrdKt0
Name 1-(4-Methylphenyl)sulfonylhex-5-en-2-ol
CAS Registry Number 129665-56-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O3S
InChI InChI=1S/C13H18O3S/c1-3-4-5-12(14)10-17(15,16)13-8-6-11(2)7-9-13/h3,6-9,12,14H,1,4-5,10H2,2H3
InChIKey ANGOWJLOHLJYTI-UHFFFAOYSA-N
Molecular Weight 254.344 g/mol
SMILES OC(CS(c1ccc(cc1)C)(=O)=O)CCC=C
SPLASH splash10-000x-9400000000-21f67119983add5207f9
Source of Spectrum F-46-3998-2
Synonyms 1-(p-tolylsulfonyl)hex-5-en-2-ol 1-Tosylhex-5-en-2-ol
Wiley ID 1257477