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(+-)-9,12-Dimethyl-2,6-dithia[7]paracyclophane
SpectraBase Compound ID JjBTBQIHUq4
InChI InChI=1S/C13H18S2/c1-10-6-13-9-15-5-3-4-14-8-12(10)7-11(13)2/h6-7H,3-5,8-9H2,1-2H3
InChIKey KGLVVPAMAXKWIM-UHFFFAOYSA-N
Mol Weight 238.41 g/mol
Molecular Formula C13H18S2
Exact Mass 238.084993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2w3TNzlXndY
Name (+-)-9,12-Dimethyl-2,6-dithia[7]paracyclophane
Alternate Name(s) 10,12-dimethyl-3,7-dithiabicyclo[7.2.2]trideca-1(11),9,12-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18S2
InChI InChI=1S/C13H18S2/c1-10-6-13-9-15-5-3-4-14-8-12(10)7-11(13)2/h6-7H,3-5,8-9H2,1-2H3
InChIKey KGLVVPAMAXKWIM-UHFFFAOYSA-N
Molecular Weight 238.407 g/mol
SMILES c12cc(C)c(cc2C)CSCCCSC1
SPLASH splash10-001i-1910000000-da349e3348f9332fd2c5
Source of Spectrum F-52-10050-1
Wiley ID 797824