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1,3-Propanedisulfonic acid, di(4-methylphenyl)ester

View entire compound with spectra: 2 MS (GC)

1,3-Propanedisulfonic acid, di(4-methylphenyl)ester
SpectraBase Compound ID AtHXsGOURGd
InChI InChI=1S/C17H20O6S2/c1-14-4-8-16(9-5-14)22-24(18,19)12-3-13-25(20,21)23-17-10-6-15(2)7-11-17/h4-11H,3,12-13H2,1-2H3
InChIKey FOKGAIPRTDPFJP-UHFFFAOYSA-N
Mol Weight 384.46 g/mol
Molecular Formula C17H20O6S2
Exact Mass 384.070131 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A24gKxlrcll
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H20O6S2
InChI InChI=1S/C17H20O6S2/c1-14-4-8-16(9-5-14)22-24(18,19)12-3-13-25(20,21)23-17-10-6-15(2)7-11-17/h4-11H,3,12-13H2,1-2H3
InChIKey FOKGAIPRTDPFJP-UHFFFAOYSA-N
Molecular Weight 384.0696
SMILES c1(OS(CCCS(Oc2ccc(C)cc2)(=O)=O)(=O)=O)ccc(C)cc1
SPLASH splash10-08fu-9750000000-afaa211e59ca374fb92a
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany