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S-Methyl-S-((rac)-[2.2]paracyclophan-4-yl)methyl dithiocarbonate
SpectraBase Compound ID Zn8OTNx10u
InChI InChI=1S/C19H20OS2/c1-21-19(20)22-13-18-12-16-7-6-14-2-4-15(5-3-14)8-10-17(18)11-9-16/h2-5,9,11-12H,6-8,10,13H2,1H3
InChIKey NCTYNHRRYBDPKY-UHFFFAOYSA-N
Mol Weight 328.49 g/mol
Molecular Formula C19H20OS2
Exact Mass 328.095558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxKFRJWPY8V
Name S-Methyl-S-((rac)-[2.2]paracyclophan-4-yl)methyl dithiocarbonate
Alternate Name(s) S-(1,4(1,4)-dibenzenacyclohexaphane-1(2)-ylmethyl) S-methyl carbonodithioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20OS2
InChI InChI=1S/C19H20OS2/c1-21-19(20)22-13-18-12-16-7-6-14-2-4-15(5-3-14)8-10-17(18)11-9-16/h2-5,9,11-12H,6-8,10,13H2,1H3
InChIKey NCTYNHRRYBDPKY-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ijch.201100079
Molecular Weight 328.488 g/mol
SMILES c1c2c(cc(c1)CCc1ccc(cc1)CC2)CSC(SC)=O
SPLASH splash10-0gi0-1790000000-db96c502130d7528cce9
Source of Spectrum TI-52-146-4a_Me
Wiley ID 1806679