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1,2-(ethylenedisulfonyl)-4-phenyl-1-cyclohexene
SpectraBase Compound ID GE9dlwGmgK3
InChI InChI=1S/C14H16O4S2/c15-19(16)8-9-20(17,18)14-10-12(6-7-13(14)19)11-4-2-1-3-5-11/h1-5,12H,6-10H2
InChIKey IYBKGMZKWBBVKS-UHFFFAOYSA-N
Mol Weight 312.4 g/mol
Molecular Formula C14H16O4S2
Exact Mass 312.049001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LfvCNQJkVP
Name 1,2-(ethylenedisulfonyl)-4-phenyl-1-cyclohexene
Alternate Name(s) 6-Phenyl-2,3,5,6,7,8-hexahydro-1,4-benzodithiin 1,1,4,4-tetraoxide
CAS Registry Number 125659-37-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4S2
InChI InChI=1S/C14H16O4S2/c15-19(16)8-9-20(17,18)14-10-12(6-7-13(14)19)11-4-2-1-3-5-11/h1-5,12H,6-10H2
InChIKey IYBKGMZKWBBVKS-UHFFFAOYSA-N
Molecular Weight 312.398 g/mol
SMILES C1=2S(CCS(C2CCC(C1)c1ccccc1)(=O)=O)(=O)=O
SPLASH splash10-0udi-0900000000-7f637b49652c78c04fba
Source of Spectrum K-125-503-12
Wiley ID 1312937