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3,3"'-bis(methylthio)-1,1':3',1":3",1'"-quaterbicyclo[1.1.1]pentane

View entire compound with spectra: 1 MS (GC)

3,3"'-bis(methylthio)-1,1':3',1":3",1'"-quaterbicyclo[1.1.1]pentane
SpectraBase Compound ID GTeLLF1o1MY
InChI InChI=1S/C22H30S2/c1-23-21-9-19(10-21,11-21)17-3-15(4-17,5-17)16-6-18(7-16,8-16)20-12-22(13-20,14-20)24-2/h3-14H2,1-2H3
InChIKey MBCQVDBHXQZRFN-UHFFFAOYSA-N
Mol Weight 358.6 g/mol
Molecular Formula C22H30S2
Exact Mass 358.178893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JWPLVlXq8BC
Name 3,3"'-bis(methylthio)-1,1':3',1":3",1'"-quaterbicyclo[1.1.1]pentane
CAS Registry Number 115092-66-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H30S2
InChI InChI=1S/C22H30S2/c1-23-21-9-19(10-21,11-21)17-3-15(4-17,5-17)16-6-18(7-16,8-16)20-12-22(13-20,14-20)24-2/h3-14H2,1-2H3
InChIKey MBCQVDBHXQZRFN-UHFFFAOYSA-N
Molecular Weight 358.602 g/mol
SMILES C12(C34CC(C4)(C45CC(C5)(SC)C4)C3)CC(C2)(C23CC(C3)(SC)C2)C1
SPLASH splash10-0006-9300000000-a4616e8a02047a4aed58
Source of Spectrum K-121-1788-6
Synonyms 1-[3-(methylsulfanyl)bicyclo[1.1.1]pentan-1-yl]-3-{3-[3-(methylsulfanyl)bicyclo[1.1.1]pentan-1-yl]bicyclo[1.1.1]pentan-1-yl}bicyclo[1.1.1]pentane
Wiley ID 1347340