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1-(1,3-Benzodioxol-5-yl)-2-[[(4-methylphenyl)sulfonyl]oxy]ethane

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(1,3-Benzodioxol-5-yl)-2-[[(4-methylphenyl)sulfonyl]oxy]ethane
SpectraBase Compound ID FrLHGNoXP2N
InChI InChI=1S/C16H16O5S/c1-12-2-5-14(6-3-12)22(17,18)21-9-8-13-4-7-15-16(10-13)20-11-19-15/h2-7,10H,8-9,11H2,1H3
InChIKey FYPJXNPPDNIJOS-UHFFFAOYSA-N
Mol Weight 320.36 g/mol
Molecular Formula C16H16O5S
Exact Mass 320.071845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3IFuMRqBpoe
Name 1-(1,3-Benzodioxol-5-yl)-2-[[(4-methylphenyl)sulfonyl]oxy]ethane
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 320.071844784 u
Formula C16H16O5S
InChI InChI=1S/C16H16O5S/c1-12-2-5-14(6-3-12)22(17,18)21-9-8-13-4-7-15-16(10-13)20-11-19-15/h2-7,10H,8-9,11H2,1H3
InChIKey FYPJXNPPDNIJOS-UHFFFAOYSA-N
Molecular Weight 320.359 g/mol
SMILES C1=C(C=CC(=C1)C)S(=O)(OCCC1=CC2=C(C=C1)OCO2)=O